C41h49fn5o8p Cytidine, N-Acetyl-5 '--o- [4-Methodyphyl) Phenylmethyl] - Deosphoryl]
Fas Registry Nummer
159414-99-0
Schlëssel kierperlech Eegeschafte | Wäert | Bedingchmëttel |
Molekular Gewiicht | 789.83 | - |
pka (virausgesot) | 10.11 ± 0,20 | Meescht sauer Tempo: 25 ° C |
Canonesch Laachen
N # CCCOP (OC1C (F) C (OC1COP (C = C (C) C) C (C) C = CC) CC = CC = CC5 = CC5 = O) NC (= O) C) N (C (C) C) C (C) C = CC) C3 = CC = CC5 = CC5 = O) NC (= O) C) N (C (C) C) C (C) C
Isomeresch Laachen
C (c (nc (c) = O) c = c2) (c3 = cc = c) c (c) c = c3) (C4 = C) (C) (Oc) c = c4) c5 = cc = cc = c5
Inchi
Inchi = 1S / C41h49F5OP / C1-27 (2) 48 (3) 46) 46) 460.) 26-53) 55-38) 55-38) 55-38) 55-38-39 41 (30-12----130.31-14-18-39h, 11,25-26h2,1-20-34 (3-17-7) 44.30.40.48.49) / T35-, 37-------- 58-? / M1 / S1 / S1
Inchi Schlëssel
CNFKJHKDDRXNFL-UTXREMAHSA-n
1 aneren Numm fir dës Substanz
Zythidine,N-Cactetyl-5 '-O- [BIS (4-Methodyphonyl) Phenylthyl] -2 '--deoxy-2' -fluoro-, 3 '- [2-Megylothyl)
Spektre verfügbar
Mass vun Mass
Eegeschafte verfügbar
Biologesch
Chemeschen
Lipinski
Struktur verbonnen
Prowalange | Wäert | Bedingchmëttel | Quellatioun |
BIKOCONSENTRATIOUN FIELD | 8.60 | pH 1; Temp: 25 ° C | (1) ACD |
BIKOCONSENTRATIOUN FIELD | 90.3 | pH 2; Temp: 25 ° C | (1) ACD |
BIKOCONSENTRATIOUN FIELD | 3940 | pH 3; Temp: 25 ° C | (1) ACD |
BIKOCONSENTRATIOUN FIELD | 39100 | pH 4; Temp: 25 ° C | (1) ACD |
BIKOCONSENTRATIOUN FIELD | 64300 | pH 5; Temp: 25 ° C | (1) ACD |
BIKOCONSENTRATIOUN FIELD | 6810000 | pH 6; Temp: 25 ° C | (1) ACD |
BIKOCONSENTRATIOUN FIELD | 6830000 | pH 7; Temp: 25 ° C | (1) ACD |
BIKOCONSENTRATIOUN FIELD | 66800 | pH 8; Temp: 25 ° C | (1) ACD |
BIKOCONSENTRATIOUN FIELD | 54300 | pH 9; Temp: 25 ° C | (1) ACD |
BIKOCONSENTRATIOUN FIELD | 19200 | ph 10; Temp: 25 ° C | (1) ACD |
(1) berechent mat fortgeschratt Chimite Entwécklung (Acd / Labs) Software V1102 (© 1994-2023 ACD / Labs)
Prowalange | Wäert | Bedingchmëttel | Quellatioun |
Kokéieren | 12.6 | pH 1; Temp: 25 ° C | (1) ACD |
Kokéieren | 133 | pH 2; Temp: 25 ° C | (1) ACD |
Kokéieren | 5790 | pH 3; Temp: 25 ° C | (1) ACD |
Kokéieren | 57400 | pH 4; Temp: 25 ° C | (1) ACD |
Kokéieren | 94500 | pH 5; Temp: 25 ° C | (1) ACD |
Kokéieren | 1.00 x 105 | pH 6; Temp: 25 ° C | (1) ACD |
Kokéieren | 1.00 x 105 | pH 7; Temp: 25 ° C | (1) ACD |
Kokéieren | 98200 | pH 8; Temp: 25 ° C | (1) ACD |
Kokéieren | 79700 | pH 9; Temp: 25 ° C | (1) ACD |
Kokéieren | 28200 | ph 10; Temp: 25 ° C | (1) ACD |
Prowalange | Wäert | Bedingchmëttel | Quellatioun |
Aloggenlogt | 2.76 | pH 1; Temp: 25 ° C | (1) ACD |
Aloggenlogt | 3.79 | pH 2; Temp: 25 ° C | (1) ACD |
Aloggenlogt | 5.43 | pH 3; Temp: 25 ° C | (1) ACD |
Aloggenlogt | 6.42 | pH 4; Temp: 25 ° C | (1) ACD |
Aloggenlogt | 6.64 | pH 5; Temp: 25 ° C | (1) ACD |
Aloggenlogt | 6.66 | pH 6; Temp: 25 ° C | (1) ACD |
Aloggenlogt | 6.66 | pH 7; Temp: 25 ° C | (1) ACD |
Aloggenlogt | 6,65 | pH 8; Temp: 25 ° C | (1) ACD |
Aloggenlogt | 6.56 | pH 9; Temp: 25 ° C | (1) ACD |
Aloggenlogt | 6.11 | ph 10; Temp: 25 ° C | (1) ACD |
AloggenO Aloggen | 6.666 ± 0.764 | Temp: 25 ° C | (1) ACD |
Mass intrinsesch Solubilitéit | 4,5 x 10-5 g / l | Temp: 25 ° C | (1) ACD |
Massebelibilitéit | 0,36 g / l | pH 1; Temp: 25 ° C | (1) ACD |
Massebelibilitéit | 0,035 G / L | pH 2; Temp: 25 ° C | (1) ACD |
Massebelibilitéit | 7.90 x 10-4 g / l | pH 3; Temp: 25 ° C | (1) ACD |
Massebelibilitéit | 7.9 x 10-5 g / l | pH 4; Temp: 25 ° C | (1) ACD |
Massebelibilitéit | 4.8 x 10-5 g / l | pH 5; Temp: 25 ° C | (1) ACD |
Massebelibilitéit | 4.6 x 10-5 g / l | pH 6; Temp: 25 ° C | (1) ACD |
Massebelibilitéit | 4.6 x 10-5 g / l | pH 7; Temp: 25 ° C | (1) ACD |
Massebelibilitéit | 4.7 x 10-5 g / l | pH 8; Temp: 25 ° C | (1) ACD |
Massebelibilitéit | 5.7 x 10-5 g / l | pH 9; Temp: 25 ° C | (1) ACD |
Massebelibilitéit | 1.6 x 10-4 g / l | ph 10; Temp: 25 ° C | (1) ACD |
Massebelibilitéit | 4.6 x 10-5 g / l | Ongebrach Waasser ph 7.00; Temp: 25 ° C | (1) ACD |
Molar intrinsesch Solubilitéit | 5.7 x 10-8 MOL / L | Temp: 25 ° C | (1) ACD |
Molar sublabilitéit | 4.6 X 10-4 MOL / L | pH 1; Temp: 25 ° C | (1) ACD |
Molar sublabilitéit | 4.4 x 10-5 MOL / L | pH 2; Temp: 25 ° C | (1) ACD |
Molar sublabilitéit | 1.00 X 10-6 MOL / L | pH 3; Temp: 25 ° C | (1) ACD |
Molar sublabilitéit | 1.0 x 10-7 Mol / l | pH 4; Temp: 25 ° C | (1) ACD |
Molar sublabilitéit | 6.1 X 10-8 MOL / L | pH 5; Temp: 25 ° C | (1) ACD |
Molar sublabilitéit | 5.8 X 10-8 MOL / L | pH 6; Temp: 25 ° C | (1) ACD |
Molar sublabilitéit | 5.8 X 10-8 MOL / L | pH 7; Temp: 25 ° C | (1) ACD |
Molar sublabilitéit | 5.9 X 10-8 MOL / L | pH 8; Temp: 25 ° C | (1) ACD |
Prowalange | Wäert | Bedingchmëttel | Quellatioun |
Molar sublabilitéit | 7.2 x 10-8 MOL / L | pH 9; Temp: 25 ° C | (1) ACD |
Molar sublabilitéit | 2.0 x 10-7 MOL / L | ph 10; Temp: 25 ° C | (1) ACD |
Molar sublabilitéit | 5.8 X 10-8 MOL / L | Ongebrach Waasser ph 7.00; Temp: 25 ° C | (1) ACD |
Molekular Gewiicht | 789.83 | ||
paka | 10.11 ± 0,20 | Meescht sauer Tempo: 25 ° C | (1) ACD |
paka | 3.57 ± 0,20 | Déi meescht Basis Tempo: 25 ° C | (1) ACD |
(1) berechent mat fortgeschratt Chimite Entwécklung (Acd / Labs) Software V1102 (© 1994-2023 ACD / Labs)
Prowalange | Wäert | Konditiounsquell |
Polarfläch | 158 A2 | (1) ACD |
(1) berechent mat fortgeschratt Chimite Entwécklung (Acd / Labs) Software V1102 (© 1994-2023 ACD / Labs)