C53H66n7o -SIPYSI Nr. Methylethyl) Phosphoramidite] (ACI)

Produktenzelel

C53H66n7o -SIPYSI Nr. Methylethyl) Phosphoramidite] (ACI)

Basis Informatioun:


Promrat Detail

Produktiounsnagéieren

Stoff Detail

Fas Registry Nummer

104992-55-4

Schlëssel kierperlech Eegeschafte Wäert Bedingchmëttel
Molekular Gewiicht 988.19 -
pka (virausgesot) 7.87 ± 0,43 Meescht sauer Tempo: 25 ° C

Aner Nimm an Identifizéierer

Canonesch Laachen

N # CCCOP (OC = 5c = CC = CC5) (C6 = CC32) NC (OC) C = 4C = CC = CC4) CC4) CC = CS] CCA (CC = CC4) CC = CC4) CC = CB4) CA (CI) CS) C) CCCOP (C = 5C = CC5) (C6 = CC32) NC (OC) C = CC = CC = CC4) CC = CS] CC4) CAC = CC4) CC = CC4) CC = CC4) CC = CC4) CC = CC4) CCA (CI] CI) CI) CS) C) CCC (C = CCA = CC5) (C6 = CC32) NC (OC) C = CC = CC4 CC = C (oc) c = C7) n (c (c) c) c (c) c

Isomeresch Laachen

C (oc [c @@h) n2C = 3c (n = c2) = c) c (o) c4 = CC = CC = CI) (C) (C) (C. N = cn3) (c5 = cc = c (oc) c = c5) (c6 = cc = c (oc) c = c6) C7 = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC

Inchi

Inchi = 1s / c53H66n7POPSI / C1-36 (25--- (3) 38-24-40-18-31-54) 39-17-17-17-22-39.40-23-276 (2) 60- (3) 48-240-40 ) 45-25-29-43 (68-50 (68-51-59-19-14-12-15-15-30) 59 (59-35-57-45-57-45-57) 59-35-55-5700 39) 59) 59-35-5700 PR15 BR15 BR15 BR15 BR15 D1) 59-35-5700 PR15-45-57) 59-35-5700 PR15-45-57) 59) 59-35-55-5700 PR15-45-55-5700 PR15 2-17,1,19-30,34-3,44, 54601?

Inchi Schlëssel

FfxhncnNasxct-rfmfgjhusa-n

1 aneren Numm fir dës Substanz

ADNOONSINE,N-Benzoyl-5 '-O- [BIS (4-Joretixophyl) Phenylmthyl] -2 '-O- [1.1-Dimethylylyl) Dimethylsilyl] -, 3 '- [2-Cyanothyl Bis (1- Methylhoder) Phosphoder)

Experimentell Spektre

Spektre verfügbar
Mass vun Mass

Virausgesot Eegeschafte

Eegeschafte verfügbar
Biologesch
Chemeschen
Lipinski
Struktur verbonnen

Biologesch

Prowalange Wäert Bedingchmëttel Quellatioun
BIKOCONSENTRATIOUN FIELD 5.50 x 105 pH 1; Temp: 25 ° C (1) ACD
BIKOCONSENTRATIOUN FIELD 1.00 x 106 pH 2; Temp: 25 ° C (1) ACD
BIKOCONSENTRATIOUN FIELD 1.00 x 106 pH 3; Temp: 25 ° C (1) ACD
BIKOCONSENTRATIOUN FIELD 1.00 x 106 pH 4; Temp: 25 ° C (1) ACD
BIKOCONSENTRATIOUN FIELD 1.00 x 106 pH 5; Temp: 25 ° C (1) ACD
BIKOCONSENTRATIOUN FIELD 1.00 x 106 pH 6; Temp: 25 ° C (1) ACD
BIKOCONSENTRATIOUN FIELD 1.00 x 106 pH 7; Temp: 25 ° C (1) ACD
BIKOCONSENTRATIOUN FIELD 1.00 x 106 pH 8; Temp: 25 ° C (1) ACD
BIKOCONSENTRATIOUN FIELD 1.00 x 106 pH 9; Temp: 25 ° C (1) ACD
BIKOCONSENTRATIOUN FIELD 1.00 x 106 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 615500 pH 1; Temp: 25 ° C (1) ACD
Kokéieren 1.64 x 106 pH 2; Temp: 25 ° C (1) ACD
Kokéieren 1.00 x 107 pH 3; Temp: 25 ° C (1) ACD
Kokéieren 1.00 x 107 pH 4; Temp: 25 ° C (1) ACD
Kokéieren 1.00 x 107 pH 5; Temp: 25 ° C (1) ACD
Kokéieren 1.00 x 107 pH 6; Temp: 25 ° C (1) ACD
Kokéieren 1.00 x 107 pH 7; Temp: 25 ° C (1) ACD
Kokéieren 1.00 x 107 pH 8; Temp: 25 ° C (1) ACD
Kokéieren 3.20 x 106 pH 9; Temp: 25 ° C (1) ACD

 

Prowalange Wäert Bedingchmëttel Quellatioun
Kokéieren 9.24 x 105 ph 10; Temp: 25 ° C (1) ACD
Aloggenlogt 8.81 pH 1; Temp: 25 ° C (1) ACD
Aloggenlogt 10.244 pH 2; Temp: 25 ° C (1) ACD
Aloggenlogt 11.244 pH 3; Temp: 25 ° C (1) ACD
Aloggenlogt 11.73 pH 4; Temp: 25 ° C (1) ACD
Aloggenlogt 11.83 pH 5; Temp: 25 ° C (1) ACD
Aloggenlogt 11.83 pH 6; Temp: 25 ° C (1) ACD
Aloggenlogt 11.75 pH 7; Temp: 25 ° C (1) ACD
Aloggenlogt 11.31 pH 8; Temp: 25 ° C (1) ACD
Aloggenlogt 10.53 pH 9; Temp: 25 ° C (1) ACD
Aloggenlogt 9.99 ph 10; Temp: 25 ° C (1) ACD
AloggenO Aloggen 11.845 ± 0.715 Temp: 25 ° C (1) ACD
Mass intrinsesch Solubilitéit 1.2 x 10-5 g / l Temp: 25 ° C (1) ACD
Massebelibilitéit 3,5 x 10-3 g / l pH 1; Temp: 25 ° C (1) ACD
Massebelibilitéit 1.1 x 10-4 g / l pH 2; Temp: 25 ° C (1) ACD
Massebelibilitéit 9.9 x 10-6 g / l pH 3; Temp: 25 ° C (1) ACD
Massebelibilitéit 3.4 x 10-6 g / l pH 4; Temp: 25 ° C (1) ACD
Massebelibilitéit 2.7 x 10-6 g / l pH 5; Temp: 25 ° C (1) ACD
Massebelibilitéit 2.7 x 10-6 g / l pH 6; Temp: 25 ° C (1) ACD
Massebelibilitéit 3.2 x 10-6 g / l pH 7; Temp: 25 ° C (1) ACD
Massebelibilitéit 8.9 X 10-6 g / l pH 8; Temp: 25 ° C (1) ACD
Massebelibilitéit 6.3 x 10-5 g / l pH 9; Temp: 25 ° C (1) ACD
Massebelibilitéit 4.2 x 10-4 g / l ph 10; Temp: 25 ° C (1) ACD
Massebelibilitéit 3.2 x 10-6 g / l Ongebrach Waasser ph 7.00; Temp: 25 ° C (1) ACD
Molar intrinsesch Solubilitéit 1.2 X 10-8 MOL / L Temp: 25 ° C (1) ACD
Molar sublabilitéit 3.5 x 10-6 MOL / L pH 1; Temp: 25 ° C (1) ACD
Molar sublabilitéit 1.1 x 10-7 Mol / l pH 2; Temp: 25 ° C (1) ACD
Molar sublabilitéit 1.0 x 10-8 MOL / L pH 3; Temp: 25 ° C (1) ACD
Molar sublabilitéit 3.4 x 10-9 MOL / L pH 4; Temp: 25 ° C (1) ACD
Molar sublabilitéit 2,7 x 10-9 MOL / L pH 5; Temp: 25 ° C (1) ACD
Molar sublabilitéit 2,7 x 10-9 MOL / L pH 6; Temp: 25 ° C (1) ACD
Molar sublabilitéit 3.2 x 10-9 MOL / L pH 7; Temp: 25 ° C (1) ACD

 

Prowalange Wäert Bedingchmëttel Quellatioun
Molar sublabilitéit 9.0 x 10-9 MOL / L pH 8; Temp: 25 ° C (1) ACD
Molar sublabilitéit 6.4 x 10-8 MOL / L pH 9; Temp: 25 ° C (1) ACD
Molar sublabilitéit 4.2 X 10-7 MOL / L ph 10; Temp: 25 ° C (1) ACD
Molar sublabilitéit 3.2 x 10-9 MOL / L Ongebrach Waasser ph 7.00; Temp: 25 ° C (1) ACD
Molekular Gewiicht 988.19
paka 7.87 ± 0,43 Meescht sauer Tempo: 25 ° C (1) ACD
paka 3.45 ± 0.70 Déi meescht Basis Tempo: 25 ° C (1) ACD

(1) berechent mat fortgeschratt Chimite Entwécklung (Acd / Labs) Software V1102 (© 1994-2023 ACD / Labs)

Lipinski

Prowalange Wäert Bedingchmëttel Quellatioun
Fräi rotativ Obligatiounen 21   (1) ACD
H Akzeptoren 15   (1) ACD
H Donateuren 1   (1) ACD
H Spender / Acceptor Zomm 16   (1) ACD
AloggenO Aloggen 11.845 ± 0.715 Temp: 25 ° C (1) ACD
Molekular Gewiicht 988.19    

Ausgerechent

Prowalange Wäert Konditiounsquell
Polarfläch 178 A2 Bues 178 (1) ACD

Struktur verbonnen

(1) berechent mat fortgeschratt Chimite Entwécklung (Acd / Labs) Software V1102 (© 1994-2023 ACD / Labs)

Fortgeschratt Chimite Entwécklung (Acd / Labs) Software V110.02 (© 1994-2023 ACD / Labs)

Virausgesot Spektra

Spektre verfügbar
1 h nmr
13 c nmr


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