C53h66n7o8psi cas no.: 104992-55-4 adenosine, n-benzoyl-5 '-O- [bis (4-methyphenyl) phenylmethyl] -2' - (1,1-dimethylethyl) -, 3 '- 2 - methayylethyl) phosphoramidite] (aci)
Laharana fisoratana anarana CAS
104992-55-4
Fananana ara-batana lehibe | sarobidy | toe-javatra |
Lanjan'ny molekiola | 988.19 | - |
PKA (nambara) | 7.87 ± 0.43 | Ankamaroan'ny temps temp: 25 ° C |
Tsiky kanonika
N # CCCOP (OC1C (OC (N2C = NC = 3C (= NC = NC32) NC (= CC4) COC CC = C (OC) C = C7) 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 (c (c) c) occc # n) c) [c (n = 1 N = cn3) (c5 = cc = c (oc) c = c5)
Inchi
Inchi = 1s / c53h66n7o8psi / c1-36 (2) 60 (37 (3) 4) 69 (65-32-18-31-54) 67-46-44 (39-1-16-13-17-256-17-25242 (62-8) 28-24-8) 28-24-8) 28-24-8) 28-24-8 ) 41-25-29-43 (63-91) 30-26-41) 66-51 (47 (46) 68-70 (10,75 (10,15 (5,6) 52 (59-35-57-49 (45) 59) 58-50 (61-14-14-15-28-15-15-20-38-15-25 2-17,19-30,44,46-44,544,44,51h, 18,32-33h2,1-11H3, (H, 55665) / t44-, 47-, 47-, 69? / M1 / s1
Inchi Key
Ffxhncnnhasxct-rfmfgjhusa-n
1 anarana hafa ho an'ity akora ity
Adenosine,N-benzoyl-5 '-O- [bis (4-metoxylhenchyl) phenylmethyl] -2 '-O- [(1,1-dimethethylethyl) dimethylilyl] -, 3 '- [2-cyanoethyl bis (1- methylethyl) phosphoramidite] (9ci)
Spectra misy
-bahoaka
Fananana misy
niteraka
simika
Lipinski
Mifandraika mifandraika
NY FANANANA | sarobidy | toe-javatra | Source |
Factor Bioconcentration | 5.50 x 105 | PH 1; Temp: 25 ° C | (1) ACD |
Factor Bioconcentration | 1.00 x 106 | PH 2; Temp: 25 ° C | (1) ACD |
Factor Bioconcentration | 1.00 x 106 | PP 3; Temp: 25 ° C | (1) ACD |
Factor Bioconcentration | 1.00 x 106 | PH 4; Temp: 25 ° C | (1) ACD |
Factor Bioconcentration | 1.00 x 106 | PH 5; Temp: 25 ° C | (1) ACD |
Factor Bioconcentration | 1.00 x 106 | PH 6; Temp: 25 ° C | (1) ACD |
Factor Bioconcentration | 1.00 x 106 | PH 7; Temp: 25 ° C | (1) ACD |
Factor Bioconcentration | 1.00 x 106 | PH 8; Temp: 25 ° C | (1) ACD |
Factor Bioconcentration | 1.00 x 106 | PH 9; Temp: 25 ° C | (1) ACD |
Factor Bioconcentration | 1.00 x 106 | PH 10; 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 |
Koc | 61500 | PH 1; Temp: 25 ° C | (1) ACD |
Koc | 1.64 x 106 | PH 2; Temp: 25 ° C | (1) ACD |
Koc | 1.00 x 107 | PP 3; Temp: 25 ° C | (1) ACD |
Koc | 1.00 x 107 | PH 4; Temp: 25 ° C | (1) ACD |
Koc | 1.00 x 107 | PH 5; Temp: 25 ° C | (1) ACD |
Koc | 1.00 x 107 | PH 6; Temp: 25 ° C | (1) ACD |
Koc | 1.00 x 107 | PH 7; Temp: 25 ° C | (1) ACD |
Koc | 1.00 x 107 | PH 8; Temp: 25 ° C | (1) ACD |
Koc | 3.20 x 106 | PH 9; Temp: 25 ° C | (1) ACD |
NY FANANANA | sarobidy | toe-javatra | Source |
Koc | 9.24 x 105 | PH 10; Temp: 25 ° C | (1) ACD |
LogD | 8.81 | PH 1; Temp: 25 ° C | (1) ACD |
LogD | 10.24 | PH 2; Temp: 25 ° C | (1) ACD |
LogD | 11.24 | PP 3; Temp: 25 ° C | (1) ACD |
LogD | 11.73 | PH 4; Temp: 25 ° C | (1) ACD |
LogD | 11.83 | PH 5; Temp: 25 ° C | (1) ACD |
LogD | 11.83 | PH 6; Temp: 25 ° C | (1) ACD |
LogD | 11.75 | PH 7; Temp: 25 ° C | (1) ACD |
LogD | 11.31 | PH 8; Temp: 25 ° C | (1) ACD |
LogD | 10.53 | PH 9; Temp: 25 ° C | (1) ACD |
LogD | 9.99 | PH 10; Temp: 25 ° C | (1) ACD |
Logp | 11.845 ± 0.715 | Temp: 25 ° C | (1) ACD |
Solondrailala an-tsokosoko | 1.2 x 10-5 g / l | Temp: 25 ° C | (1) ACD |
Supubility Mass | 3.5 x 10-3 g / l | PH 1; Temp: 25 ° C | (1) ACD |
Supubility Mass | 1.1 x 10-4 g / l | PH 2; Temp: 25 ° C | (1) ACD |
Supubility Mass | 9.9 x 10-6 g / l | PP 3; Temp: 25 ° C | (1) ACD |
Supubility Mass | 3.4 x 10-6 g / l | PH 4; Temp: 25 ° C | (1) ACD |
Supubility Mass | 2.7 x 10-6 g / l | PH 5; Temp: 25 ° C | (1) ACD |
Supubility Mass | 2.7 x 10-6 g / l | PH 6; Temp: 25 ° C | (1) ACD |
Supubility Mass | 3.2 x 10-6 g / l | PH 7; Temp: 25 ° C | (1) ACD |
Supubility Mass | 8.9 x 10-6 g / l | PH 8; Temp: 25 ° C | (1) ACD |
Supubility Mass | 6.3 x 10-5 g / l | PH 9; Temp: 25 ° C | (1) ACD |
Supubility Mass | 4.2 x 10-4 g / l | PH 10; Temp: 25 ° C | (1) ACD |
Supubility Mass | 3.2 x 10-6 g / l | PH 7 7,00; Temp: 25 ° C | (1) ACD |
Movra intrinsic solubility | 1.2 x 10-8 mol / l | Temp: 25 ° C | (1) ACD |
Molar Solubility | 3.5 x 10-6 Mol / l | PH 1; Temp: 25 ° C | (1) ACD |
Molar Solubility | 1.1 x 10-7 mol / l | PH 2; Temp: 25 ° C | (1) ACD |
Molar Solubility | 1.0 x 10-8 mol / l | PP 3; Temp: 25 ° C | (1) ACD |
Molar Solubility | 3.4 x 10-9 mol / l | PH 4; Temp: 25 ° C | (1) ACD |
Molar Solubility | 2.7 x 10-9 Mol / l | PH 5; Temp: 25 ° C | (1) ACD |
Molar Solubility | 2.7 x 10-9 Mol / l | PH 6; Temp: 25 ° C | (1) ACD |
Molar Solubility | 3.2 x 10-9 Mol / l | PH 7; Temp: 25 ° C | (1) ACD |
NY FANANANA | sarobidy | toe-javatra | Source |
Molar Solubility | 9.0 x 10-9 mol / l | PH 8; Temp: 25 ° C | (1) ACD |
Molar Solubility | 6.4 x 10-8 mol / l | PH 9; Temp: 25 ° C | (1) ACD |
Molar Solubility | 4.2 x 10-7 mol / l | PH 10; Temp: 25 ° C | (1) ACD |
Molar Solubility | 3.2 x 10-9 Mol / l | PH 7 7,00; Temp: 25 ° C | (1) ACD |
Lanjan'ny molekiola | 988.19 | ||
pka | 7.87 ± 0.43 | Ankamaroan'ny temps temp: 25 ° C | (1) ACD |
pka | 3.45 ± 0.70 | 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 | 21 | (1) ACD | |
H Mpanaja | 15 | (1) ACD | |
H mpamatsy vola | 1 | (1) ACD | |
H Donor / Accas Sum | 16 | (1) ACD | |
Logp | 11.845 ± 0.715 | Temp: 25 ° C | (1) ACD |
Lanjan'ny molekiola | 988.19 |
NY FANANANA | sarobidy | Loharano fepetra |
Faritra misy polar | 178 A2 | (1) ACD |
(1) kajy amin'ny fampandrosoana ny simika Advanced (ACD / Labs) rindrambaiko V11.02 (© 1994-2023 ACD / Labs)
Fampandrosoana ny simika Advanced (ACD / Labs) rindrambaiko V11.02 (© 1994-2023 ACD / Labs)
Spectra misy
1 h nmr
13 C NMR