118 Re36h44n2o8si uridine, 5'-o- [4-Methodylyl) Phenylthyl)
Schlëssel kierperlech Eegeschafte | Wäert | Bedingchmëttel |
Molekular Gewiicht | 660.83 | - |
Dicht (virausgesot) | 1.24 ± 0,1 G / CM3 | Trëpp: 20 ° C; Press: 760 Torr |
pka (virausgesot) | 9.39 ± 0,10 | Meescht sauer Tempo: 25 ° C |
Canonesch Laachen O = C1C = CN (C (= O) C2C (CC) c
Isomeresch Laachen
C (o) c = c2) (c3 = cc = c (oc) c = c3) (c4 = cc = c) c = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = C.
Inchi
Inchii oxéieren 480) 1 4-40) 2,4) 1 44) 39) 23) 29) 29) 17-27 (42-405) 26-19-19--, 33-5) 20----------2.29,413h3h3,40h3,40h3,40h3, 23h2h3h3,40h3, 23-27,7,7,7,7,39.41) / t29-, 31--------------2.29,313.40h3h, 23h2h3h30h, 23h2h3h3, 237-7,7-,4-27,7,39.41 )--28--, 31------------- M1 / S1,40.40h3
Inchi Schlëssel
Kvhqielphwjpsy-wxqjyutersa-n
2 aner Nimm fir dës Substanz
5'-O- [4-Methodyphonyl) Phenylthyl] -2'-O - [(1.1-Dimethylylyl) DIDTHYLSLYL) DIDIGHYLYL) 2'-o-Tert-thypldimhyllsilyl-5'-o- (4,4'- Dimethoxyrityl) Uridine
Spektre verfügbar
1h nmr
13c nmr
Hetero nmr
Mass vun Mass
Eegeschafte verfügbar |
Biologesch |
Chemeschen |
Dicht |
Lipinski |
Struktur verbonnen |
Biologesch
Prowalange | Wäert | Bedingchmëttel | Quellatioun |
BIKOCONSENTRATIOUN FIELD | 2.21 x 105 | pH 1; Temp: 25 ° C | (1) ACD |
BIKOCONSENTRATIOUN FIELD | 2.21 x 105 | pH 2; Temp: 25 ° C | (1) ACD |
BIKOCONSENTRATIOUN FIELD | 2.21 x 105 | pH 3; Temp: 25 ° C | (1) ACD |
BIKOCONSENTRATIOUN FIELD | 2.21 x 105 | pH 4; Temp: 25 ° C | (1) ACD |
BIKOCONSENTRATIOUN FIELD | 2.21 x 105 | pH 5; Temp: 25 ° C | (1) ACD |
BIKOCONSENTRATIOUN FIELD | 2.21 x 105 | pH 6; Temp: 25 ° C | (1) ACD |
BIKOCONSENTRATIOUN FIELD | 2.20 x 105 | pH 7; Temp: 25 ° C | (1) ACD |
BIKOCONSENTRATIOUN FIELD | 2.12 x 105 | pH 8; Temp: 25 ° C | (1) ACD |
BIKOCONSENTRATIOUN FIELD | 1.54 X 105 | pH 9; Temp: 25 ° C | (1) ACD |
BIKOCONSENTRATIOUN FIELD | 42500 | ph 10; Temp: 25 ° C | (1) ACD |
(1) berechent mat fortgeschratt Chimite Entwécklung (Acd / Labs) Software V1102 (© 1994-2023 ACD / Labs)
Chemeschen
Prowalange | Wäert | Bedingchmëttel | Quellatioun |
Kokéieren | 2.33 x 105 | pH 1; Temp: 25 ° C | (1) ACD |
Kokéieren | 2.33 x 105 | pH 2; Temp: 25 ° C | (1) ACD |
Kokéieren | 2.33 x 105 | pH 3; Temp: 25 ° C | (1) ACD |
Kokéieren | 2.33 x 105 | pH 4; Temp: 25 ° C | (1) ACD |
Kokéieren | 2.33 x 105 | pH 5; Temp: 25 ° C | (1) ACD |
Kokéieren | 2.33 x 105 | pH 6; Temp: 25 ° C | (1) ACD |
Prowalange | Wäert | Bedingchmëttel | Quellatioun |
Kokéieren | 2.32 x 105 | pH 7; Temp: 25 ° C | (1) ACD |
Kokéieren | 2.23 x 105 | pH 8; Temp: 25 ° C | (1) ACD |
Kokéieren | 1.62 x 105 | pH 9; Temp: 25 ° C | (1) ACD |
Kokéieren | 44800 | ph 10; Temp: 25 ° C | (1) ACD |
Aloggenlogt | 7.33 | pH 1; Temp: 25 ° C | (1) ACD |
Aloggenlogt | 7.33 | pH 2; Temp: 25 ° C | (1) ACD |
Aloggenlogt | 7.33 | pH 3; Temp: 25 ° C | (1) ACD |
Aloggenlogt | 7.33 | pH 4; Temp: 25 ° C | (1) ACD |
Aloggenlogt | 7.33 | pH 5; Temp: 25 ° C | (1) ACD |
Aloggenlogt | 7.33 | pH 6; Temp: 25 ° C | (1) ACD |
Aloggenlogt | 7.33 | pH 7; Temp: 25 ° C | (1) ACD |
Aloggenlogt | 7.32 | pH 8; Temp: 25 ° C | (1) ACD |
Aloggenlogt | 7.1,18 | pH 9; Temp: 25 ° C | (1) ACD |
Aloggenlogt | 6.62 | ph 10; Temp: 25 ° C | (1) ACD |
AloggenO Aloggen | 7.334 ± 0,643 | Temp: 25 ° C | (1) ACD |
Mass intrinsesch Solubilitéit | 3,5 x 10-5 g / l | Temp: 25 ° C | (1) ACD |
Massebelibilitéit | 3,5 x 10-5 g / l | pH 1; Temp: 25 ° C | (1) ACD |
Massebelibilitéit | 3,5 x 10-5 g / l | pH 2; Temp: 25 ° C | (1) ACD |
Massebelibilitéit | 3,5 x 10-5 g / l | pH 3; Temp: 25 ° C | (1) ACD |
Massebelibilitéit | 3,5 x 10-5 g / l | pH 4; Temp: 25 ° C | (1) ACD |
Massebelibilitéit | 3,5 x 10-5 g / l | pH 5; Temp: 25 ° C | (1) ACD |
Massebelibilitéit | 3,5 x 10-5 g / l | pH 6; Temp: 25 ° C | (1) ACD |
Massebelibilitéit | 3,5 x 10-5 g / l | pH 7; Temp: 25 ° C | (1) ACD |
Massebelibilitéit | 3.6 x 10-5 g / l | pH 8; Temp: 25 ° C | (1) ACD |
Massebelibilitéit | 5.0 x 10-5 g / l | pH 9; Temp: 25 ° C | (1) ACD |
Massebelibilitéit | 1.9 X 10-4 g / l | ph 10; Temp: 25 ° C | (1) ACD |
Massebelibilitéit | 3,5 x 10-5 g / l | Ongebrach Waasser ph 7.00; Temp: 25 ° C | (1) ACD |
Molar intrinsesch Solubilitéit | 5.3 x 10-8 MOL / L | Temp: 25 ° C | (1) ACD |
Molar sublabilitéit | 5.3 x 10-8 MOL / L | pH 1; Temp: 25 ° C | (1) ACD |
Molar sublabilitéit | 5.3 x 10-8 MOL / L | pH 2; Temp: 25 ° C | (1) ACD |
Molar sublabilitéit | 5.3 x 10-8 MOL / L | pH 3; Temp: 25 ° C | (1) ACD |
Molar sublabilitéit | 5.3 x 10-8 MOL / L | pH 4; Temp: 25 ° C | (1) ACD |
Prowalange | Wäert | Bedingchmëttel | Quellatioun |
Molar sublabilitéit | 5.3 x 10-8 MOL / L | pH 5; Temp: 25 ° C | (1) ACD |
Molar sublabilitéit | 5.3 x 10-8 MOL / L | pH 6; Temp: 25 ° C | (1) ACD |
Molar sublabilitéit | 5.3 x 10-8 MOL / L | pH 7; Temp: 25 ° C | (1) ACD |
Molar sublabilitéit | 5.5 x 10-8 MOL / L | pH 8; Temp: 25 ° C | (1) ACD |
Molar sublabilitéit | 7.6 x 10-8 MOL / L | pH 9; Temp: 25 ° C | (1) ACD |
Molar sublabilitéit | 2.8 x 10-7 Mol / l | ph 10; Temp: 25 ° C | (1) ACD |
Molar sublabilitéit | 5.3 x 10-8 MOL / L | Ongebrach Waasser ph 7.00; Temp: 25 ° C | (1) ACD |
Molekular Gewiicht | 660.83 | ||
paka | 9.39 ± 0,10 | Meescht sauer Tempo: 25 ° C | (1) ACD |
(1) berechent mat fortgeschratt Chimite Entwécklung (Acd / Labs) Software V1102 (© 1994-2023 ACD / Labs)
Dicht
Prowalange | Wäert | Bedingchmëttel | Quellatioun |
Dicht | 1.24 ± 0,1 G / CM3 | Trëpp: 20 ° C; Press: 760 Torr | (1) ACD |
Molar Volumen | 528.8 ± 5.0 cm3 / Mol | Trëpp: 20 ° C; Press: 760 Torr | (1) ACD |
(1) berechent mat fortgeschratt Chimite Entwécklung (Acd / Labs) Software V1102 (© 1994-2023 ACD / Labs)
Lipinski
Prowalange | Wäert | Bedingchmëttel | Quellatioun |
Fräi rotativ Obligatiounen | 13 | (1) ACD | |
H Akzeptoren | 10 | (1) ACD | |
H Donateuren | 2 | (1) ACD | |
H Spender / Acceptor Zomm | 12 | (1) ACD | |
AloggenO Aloggen | 7.334 ± 0,643 | Temp: 25 ° C | (1) ACD |
Molekular Gewiicht | 660.83 |
(1) berechent mat fortgeschratt Chimite Entwécklung (Acd / Labs) Software V1102 (© 1994-2023 ACD / Labs)
Struktur verbonnen
Prowalange | Wäert | Bedingchmëttel | Quellatioun |
Polarfläch | 116 A2 | (1) ACD |
(1) berechent mat fortgeschratt Chimite Entwécklung (Acd / Labs) Software V1102 (© 1994-2023 ACD / Labs)
Spektre verfügbar
1h nmr
13c nmr