C44H49N5O7SI Adenosine, N-Benzoyl-5'-O- [Bis (4-on (((((((((9ci, aside)
Imbaraga z'umubiri | Agaciro | Imiterere |
Uburemere bwa molekile | 787.98 | - |
Ubucucike (bwahanuwe) | 1.23 ± 0.1 G / CM3 | Temp: 20 ° C; Kanda: 760 Torr |
PKA (byahanuwe) | 7.87 ± 0.43 | Acide menshi: 25 ° C. |
Inseko ya kanonical
O = c (nc1 = nc = nc2 = cnn = cn2c3oc (coc (cc = cc = cc) cc (cc) (cc) (cc) (cc = cc = cc = cc = cc = cc = cc = cc = cc = cc
Isomenic kumwenyura
C (OC [C @ H] 1o [c @ h] (c) (o] (c) c) (c) c) (c) (c2) = c (n C (= o) c4 = cc = cc = c4) n = cn3) (C5 = C.
Inchi
InChI=1S/C44H49N5O7Si/c1-43(2,3)57(6,7)56-38-37(50)35(55-42(38)49-28-47-36-39(45-27-46-40(36)49)48-41(51)29-14-10-8-11-15-2 9) 26-54-44 (30-16-12-9-13-30,3-30,31-18-22-33 (52-4) 23-19-31) 25-21-32 / H8,50H, 26h2,3h3, (h,
45,46.48,58) / t35-, 37-8-8- 32- / M1 / S1
Inchi
Dazigopasnjpcj-Gnecshawsa-n
2 Andi mazina kuriyi ngingo
N-benzoyl-5'-O- [Bis (4-uburyo bwo buryo) phenylmethyl] -2'-O - [((((((((1,1-Dimethysilyl) Dimethysilyl) adinosine (aside); N6-Benzoyl-5'-O- (4,4'- Dimethoxytrityl) -2'-O- (Tert-ButyldimethylliSilyl) adenosone
Spectra irahari
1h nmr
Hetero nmr
Ibyiza birahari |
Ibinyabuzima |
Imiti |
Ubucucike |
Lipinski |
Imiterere |
Ibinyabuzima
Umutungo | Agaciro | Imiterere | Isoko |
BioConcentration | 1.00 x 106 | ph 1; Temp: 25 ° C. | (1) acd |
BioConcentration | 1.00 x 106 | ph 2; Temp: 25 ° C. | (1) acd |
BioConcentration | 1.00 x 106 | ph 3; Temp: 25 ° C. | (1) acd |
BioConcentration | 1.00 x 106 | ph 4; Temp: 25 ° C. | (1) acd |
BioConcentration | 1.00 x 106 | ph 5; Temp: 25 ° C. | (1) acd |
BioConcentration | 1.00 x 106 | pH 6; Temp: 25 ° C. | (1) acd |
BioConcentration | 1.00 x 106 | pH 7; Temp: 25 ° C. | (1) acd |
BioConcentration | 1.00 x 106 | ph 8; Temp: 25 ° C. | (1) acd |
BioConcentration | 1.00 x 106 | pH 9; Temp: 25 ° C. | (1) acd |
BioConcentration | 5.41 X 105 | PH 10; Temp: 25 ° C. | (1) acd |
(1) kubarwa ukoresheje iterambere rya chimie ihamye (acd / laboratwari) software v11.02 (© 1994-2023 acd
Imiti
Umutungo | Agaciro | Imiterere | Isoko |
Koc | 2.01 X 106 | ph 1; Temp: 25 ° C. | (1) acd |
Koc | 6.87 X 106 | ph 2; Temp: 25 ° C. | (1) acd |
Koc | 9.08 x 106 | ph 3; Temp: 25 ° C. | (1) acd |
Koc | 9.38 x 106 | ph 4; Temp: 25 ° C. | (1) acd |
Koc | 9.39 x 106 | ph 5; Temp: 25 ° C. | (1) acd |
Koc | 9.19 x 106 | pH 6; Temp: 25 ° C. | (1) acd |
Koc | 7.53 x 106 | pH 7; Temp: 25 ° C. | (1) acd |
Umutungo | Agaciro | Imiterere | Isoko |
Koc | 2.73 X 106 | ph 8; Temp: 25 ° C. | (1) acd |
Koc | 4.48 x 105 | pH 9; Temp: 25 ° C. | (1) acd |
Koc | 1.31 x 105 | PH 10; Temp: 25 ° C. | (1) acd |
Logd | 9.62 | ph 1; Temp: 25 ° C. | (1) acd |
Logd | 10.15 | ph 2; Temp: 25 ° C. | (1) acd |
Logd | 10.27 | ph 3; Temp: 25 ° C. | (1) acd |
Logd | 10.29 | ph 4; Temp: 25 ° C. | (1) acd |
Logd | 10.29 | ph 5; Temp: 25 ° C. | (1) acd |
Logd | 10.28 | pH 6; Temp: 25 ° C. | (1) acd |
Logd | 10.19 | pH 7; Temp: 25 ° C. | (1) acd |
Logd | 9.75 | ph 8; Temp: 25 ° C. | (1) acd |
Logd | 8.97 | pH 9; Temp: 25 ° C. | (1) acd |
Logd | 8.43 | PH 10; Temp: 25 ° C. | (1) acd |
LogP | 10.291 ± 0.708 | Temp: 25 ° C. | (1) acd |
Misa yimbere | 1.1 x 10-6 g / l | Temp: 25 ° C. | (1) acd |
Rusange | 4.8 x 10-6 g / l | ph 1; Temp: 25 ° C. | (1) acd |
Rusange | 1.4 x 10-6 g / l | ph 2; Temp: 25 ° C. | (1) acd |
Rusange | 1.1 x 10-6 g / l | ph 3; Temp: 25 ° C. | (1) acd |
Rusange | 1.0 x 10-6 G / L. | ph 4; Temp: 25 ° C. | (1) acd |
Rusange | 1.0 x 10-6 G / L. | ph 5; Temp: 25 ° C. | (1) acd |
Rusange | 1.0 x 10-6 G / L. | pH 6; Temp: 25 ° C. | (1) acd |
Rusange | 1.3 x 10-6 G / L. | pH 7; Temp: 25 ° C. | (1) acd |
Rusange | 3.5 x 10-6 g / l | ph 8; Temp: 25 ° C. | (1) acd |
Rusange | 2.2 X 10-5 G / L. | pH 9; Temp: 25 ° C. | (1) acd |
Rusange | 7.6 x 10-5 g / l | PH 10; Temp: 25 ° C. | (1) acd |
Rusange | 1.3 x 10-6 G / L. | Amazi atagenzuwe PH 7.00; Temp: 25 ° C. | (1) acd |
Morlar Mainsic Lowelity | 1.4 x 10-9 mol / l | Temp: 25 ° C. | (1) acd |
Umuryango wawe | 6.1 x 10-9 Mol / l | ph 1; Temp: 25 ° C. | (1) acd |
Umuryango wawe | 1.8 x 10-9 mol / l | ph 2; Temp: 25 ° C. | (1) acd |
Umuryango wawe | 1.4 x 10-9 mol / l | ph 3; Temp: 25 ° C. | (1) acd |
Umuryango wawe | 1.3 x 10-9 Mol / l | ph 4; Temp: 25 ° C. | (1) acd |
Umuryango wawe | 1.3 x 10-9 Mol / l | ph 5; Temp: 25 ° C. | (1) acd |
Umutungo | Agaciro | Imiterere | Isoko |
Umuryango wawe | 1.3 x 10-9 Mol / l | pH 6; Temp: 25 ° C. | (1) acd |
Umuryango wawe | 1.6 x 10-9 mol / l | pH 7; Temp: 25 ° C. | (1) acd |
Umuryango wawe | 4.5 x 10-9 mol / l | ph 8; Temp: 25 ° C. | (1) acd |
Umuryango wawe | 2.8 x 10-8 mol / l | pH 9; Temp: 25 ° C. | (1) acd |
Umuryango wawe | 9.6 x 10-8 mol / l | PH 10; Temp: 25 ° C. | (1) acd |
Umuryango wawe | 1.6 x 10-9 mol / l | Amazi atagenzuwe PH 7.00; Temp: 25 ° C. | (1) acd |
Uburemere bwa molekile | 787.98 | ||
PKA | 7.87 ± 0.43 | Acide menshi: 25 ° C. | (1) acd |
PKA | 1.39 ± 0.10 | Icyiciro cyibanze: 25 ° C. | (1) acd |
(1) kubarwa ukoresheje iterambere rya chimie ihamye (acd / laboratwari) software v11.02 (© 1994-2023 acd
Ubucucike
Umutungo | Agaciro | Imiterere | Isoko |
Ubucucike | 1.23 ± 0.1 G / CM3 | Temp: 20 ° C; Kanda: 760 Torr | (1) acd |
Umubumbe | 639.5 ± 7.0 cm3 / mol | Temp: 20 ° C; Kanda: 760 Torr | (1) acd |
(1) kubarwa ukoresheje iterambere rya chimie ihamye (acd / laboratwari) software v11.02 (© 1994-2023 acd
Lipinski
Umutungo | Agaciro | Imiterere | Isoko |
Ubusambanyi bwuzuye | 14 | (1) acd | |
H yemera | 12 | (1) acd | |
H | 2 | (1) acd | |
H umuterankunga / kubyemera | 14 | (1) acd | |
LogP | 10.291 ± 0.708 | Temp: 25 ° C. | (1) acd |
Uburemere bwa molekile | 787.98 |
(1) kubarwa ukoresheje iterambere rya chimie ihamye (acd / laboratwari) software v11.02 (© 1994-2023 acd
Imiterere
Umutungo | Agaciro | Imiterere | Isoko |
Agace k'amashanyarazi | 139 A2 | (1) acd |
(1) kubarwa ukoresheje iterambere rya chimie ihamye (acd / laboratwari) software v11.02 (© 1994-2023 acd
Spectra irahari
1h nmr
13c nmr