C42H52N5O9P Cytidine, N-Acetyl-5 '-O- [BIS (4-metoxyphenyl) phenylmethyl] -2' -O- Methyl-, 3 '- 2-Cyanoethyl na, n-bis (1-methylethyl) (Aci)
Laharana fisoratana anarana CAS
199593-09-4
Fananana ara-batana lehibe | sarobidy | toe-javatra |
Lanjan'ny molekiola | 801.87 | - |
PKA (nambara) | 10.18 ± 0.20 | Ankamaroan'ny temps temp: 25 ° C |
Tsiky kanonika
N # CCCOP (OC1C (OC (NCC = CC (= NC2 = O) NC (= O) C) COC (C = 3C = C = C (OC) C = C (OC) C = C5) N (C (C (C (C (C (C (C (C (C (C (C
Mitsiky i Isomeric
C (OC [c @@ h] 1 [c @@ h] (op (n (c (c (c (n) c) occc # n) = C (OC) C = C4) C5 = CC = CC = C5
Inchi
Inchi = 1s / c42h52n5o9p / c1-28 (2) 47 (29 (3) 4) 57 (54-26-12-24-43) 56-38-36 (55-40 (39 (38) 52-8) 52-8) -42 (31-13-10-9-11-11-11-11-11-11-11-11-11-11-11-11-14-31,32-15-19-34 (50-6) 20-17-21) 33-17-21-35 (51-7) H, 44 444,48 489) / T36-, 38-9- 39-, 40-, 57? / M1 / s1
Inchi Key
Wnwumipfloktez-uaqipllsa-n
1 anarana hafa ho an'ity akora ity
Cytidine,N-acetyl-5 '-O- [bis (4-metoxylhenchyl) phenylmethyl] -2 '-O-methyl-, 3 '- [2-cyanoethyl bis (1-methyledyl) phosphoramidite] (9ci)
Fananana misy
niteraka
simika
Lipinski
Mifandraika mifandraika
NY FANANANA | sarobidy | toe-javatra | Source |
Factor Bioconcentration | 4.77 | PH 1; Temp: 25 ° C | (1) ACD |
Factor Bioconcentration | 50.1 | PH 2; Temp: 25 ° C | (1) ACD |
Factor Bioconcentration | 2190 | PH 3; Temp: 25 ° C | (1) ACD |
Factor Bioconcentration | 21700 | PH 4; Temp: 25 ° C | (1) ACD |
Factor Bioconcentration | 35700 | PH 5; Temp: 25 ° C | (1) ACD |
Factor Bioconcentration | 37800 | PH 6; Temp: 25 ° C | (1) ACD |
Factor Bioconcentration | 37900 | PH 7; Temp: 25 ° C | (1) ACD |
Factor Bioconcentration | 37300 | PH 8; Temp: 25 ° C | (1) ACD |
Factor Bioconcentration | 31400 | PH 9; Temp: 25 ° C | (1) ACD |
Factor Bioconcentration | 12300 | PH 10; Temp: 25 ° C | (1) ACD |
(1) kajy amin'ny fampandrosoana ny simika Advanced (ACD / Labs) rindrambaiko V11.02 (© 1994-2023 ACD / Labs)
Loharanom-pahalalana momba ny fananana fananana |
Koc 8.29 PH 1; Temp: 25 ° C (1) ACD |
Koc 87.1 PM 2; Temp: 25 ° C (1) ACD |
Koc 3800 PP 3; Temp: 25 ° C (1) ACD |
Koc 37700 PH 4; Temp: 25 ° C (1) ACD |
Koc 62000 pH 5; Temp: 25 ° C (1) ACD |
Koc 65700 PH 6; Temp: 25 ° C (1) ACD |
Koc 65900 PH 7; Temp: 25 ° C (1) ACD |
Koc 64700 PM 8; Temp: 25 ° C (1) ACD |
Koc 54500 PH 9; Temp: 25 ° C (1) ACD |
Koc 21400 PH 10; Temp: 25 ° C (1) ACD |
LogD 2.43 PH 1; Temp: 25 ° C (1) ACD |
Logd 3.45 pH 2; Temp: 25 ° C (1) ACD |
Logd 5.09 pH 3; Temp: 25 ° C (1) ACD |
NY FANANANA | sarobidy | toe-javatra | Source |
LogD | 6.09 | PH 4; Temp: 25 ° C | (1) ACD |
LogD | 6.30 | PH 5; Temp: 25 ° C | (1) ACD |
LogD | 6.33 | PH 6; Temp: 25 ° C | (1) ACD |
LogD | 6.33 | PH 7; Temp: 25 ° C | (1) ACD |
LogD | 6.32 | PH 8; Temp: 25 ° C | (1) ACD |
LogD | 6.25 | PH 9; Temp: 25 ° C | (1) ACD |
LogD | 5.84 | PH 10; Temp: 25 ° C | (1) ACD |
Logp | 6.329 ± 0.771 | Temp: 25 ° C | (1) ACD |
Solondrailala an-tsokosoko | 1.8 x 10-4 g / l | Temp: 25 ° C | (1) ACD |
Supubility Mass | 1.4 g / l | PH 1; Temp: 25 ° C | (1) ACD |
Supubility Mass | 0.14 g / l | PH 2; Temp: 25 ° C | (1) ACD |
Supubility Mass | 3.1 x 10-3 g / l | PH 3; Temp: 25 ° C | (1) ACD |
Supubility Mass | 3.2 x 10-4 g / l | PH 4; Temp: 25 ° C | (1) ACD |
Supubility Mass | 1.9 x 10-4 g / l | PH 5; Temp: 25 ° C | (1) ACD |
Supubility Mass | 1.8 x 10-4 g / l | PH 6; Temp: 25 ° C | (1) ACD |
Supubility Mass | 1.8 x 10-4 g / l | PH 7; Temp: 25 ° C | (1) ACD |
Supubility Mass | 1.8 x 10-4 g / l | PH 8; Temp: 25 ° C | (1) ACD |
Supubility Mass | 2.2 x 10-4 g / l | PH 9; Temp: 25 ° C | (1) ACD |
Supubility Mass | 5.6 x 10-4 g / l | PH 10; Temp: 25 ° C | (1) ACD |
Supubility Mass | 1.8 x 10-4 g / l | PH 7 7,00; Temp: 25 ° C | (1) ACD |
Movra intrinsic solubility | 2.3 x 10-7 mol / l | Temp: 25 ° C | (1) ACD |
Molar Solubility | 1.8 x 10-3 Mol / l | PH 1; Temp: 25 ° C | (1) ACD |
Molar Solubility | 1.7 x 10-4 mol / l | PH 2; Temp: 25 ° C | (1) ACD |
Molar Solubility | 3.9 x 10-6 Mol / l | PH 3; Temp: 25 ° C | (1) ACD |
Molar Solubility | 4.0 x 10-7 mol / l | PH 4; Temp: 25 ° C | (1) ACD |
Molar Solubility | 2.4 x 10-7 mol / l | PH 5; Temp: 25 ° C | (1) ACD |
Molar Solubility | 2.3 x 10-7 mol / l | PH 6; Temp: 25 ° C | (1) ACD |
Molar Solubility | 2.3 x 10-7 mol / l | PH 7; Temp: 25 ° C | (1) ACD |
Molar Solubility | 2.3 x 10-7 mol / l | PH 8; Temp: 25 ° C | (1) ACD |
Molar Solubility | 2.8 x 10-7 mol / l | PH 9; Temp: 25 ° C | (1) ACD |
Molar Solubility | 7.0 x 10-7 mol / l | PH 10; Temp: 25 ° C | (1) ACD |
Molar Solubility | 2.3 x 10-7 mol / l | PH 7 7,00; Temp: 25 ° C | (1) ACD |
NY FANANANA | sarobidy | toe-javatra | Source |
Lanjan'ny molekiola | 801.87 | ||
pka | 10.18 ± 0.20 | Ankamaroan'ny temps temp: 25 ° C | (1) ACD |
pka | 3.57 ± 0.20 | Ny ankamaroan'ny Temp: 25 ° C | (1) ACD |
(1) kajy amin'ny fampandrosoana ny simika Advanced (ACD / Labs) rindrambaiko V11.02 (© 1994-2023 ACD / Labs)
NY FANANANA | sarobidy | toe-javatra | Source |
Fatorana rotatateble malalaka | 18 | (1) ACD | |
H Mpanaja | 14 | (1) ACD | |
H mpamatsy vola | 1 | (1) ACD | |
H Donor / Accas Sum | 15 | (1) ACD | |
Logp | 6.329 ± 0.771 | Temp: 25 ° C | (1) ACD |
Lanjan'ny molekiola | 801.87 |
(1) kajy amin'ny fampandrosoana ny simika Advanced (ACD / Labs) rindrambaiko V11.02 (© 1994-2023 ACD / Labs)
NY FANANANA | sarobidy | Loharano fepetra |
Faritra misy polar | 167 A2 | (1) ACD |
(1) kajy amin'ny fampandrosoana ny simika Advanced (ACD / Labs) rindrambaiko V11.02 (© 1994-2023 ACD / Labs)
Spectra misy
1H NMR
13c NMR