C53H66N7O8PSI Cas No.: 104992-55-4 '- [2-chyanothyl n, n-bis (1- Methyyoylyl) PhosphorondIite] (ACI) Ìomhaigh a tha a 'nochdadh

C53H66N7O8PSI Cas No.: 104992-55-4 '- [2-chyanothyl n, n-bis (1- methyoylyl) fosphoondidite] (ACI)

Fiosrachadh bunaiteach:

Cuir post-d thugainn

Mion-fhiosrachadh toraidh

Tagaichean toraidh

Mion-fhiosrachadh stuthan

Àireamh Clàrs Cas

104992-55-4

Prìomh thogalaichean corporra	Luach	Suidheachadh
Cuideam molecular	988.19	-
paka (ro-innse)	7.87 ± 0.43	Temp as searbhagach: 25 ° C.

Ainmean is aithnichearan eile

Smiles Canonical

N # cccop (OC1C (OC (N2C = NC = 3c (cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = cc = c4) c = c6) C7 = Cc = c (OC) c = c7) n (c (c) c) c (c) c

Gàire isomicic

C(OC[C@@H]1[C@@H](OP(N(C(C)C)C(C)C)OCCC#N)[C@@H](O[Si](C(C)(C)C)(C)C)[C@@H](O1)N2C=3C(N=C2)=C(NC(=O)C4=CC=CC=C4) N = cn3) (cc = cc = c (OC) C = c4 = cc = c (OC) C = c4) C7 = cc = cc = cc = cc = cc = cc = c

Inchi

Inchi = 1s / c53H66n7Po8psi / C1-32-52-52-3-227-42 (62-8 (62-8-40 ) 41-25-23-43 (63-9) 30-26-41) 66-51 (46) 58-48 (61) 38-19-3-20-3 / H1- 2-17,19,13,46-47,46-47,51-3H2,1h3, (46-, 49-, 51-, 69? / S1

Iuchair Inchi

Ffxhnchasxct-rfmfgjhusA-n

1 ainm eile airson an stuth seo

Adenosine,N-benzoyl-5 '-O- [BIS (4-Neach-obrach) dha na Leumnylmeyl] -2 '-O- [(1,1-dilthyledyl) dimehylsilyl] -, 3 '- [2-Cyanothyl Bis (1- Priesthyl) Fiodhoundidite] (9ci)

Speactra deuchainneach

Spectra ri fhaighinn
Maise

Togalaichean ro-innse

Togalaichean rim faighinn
Bith-eòlasach
Ceimigeach
Lipinski
Structar co-cheangailte

Bith-eòlasach

Seilbh	Luach	Suidheachadh	Stòr
Dà fhaclan bith-eòlasach	5.50 x 105	Ph 1; Temp: 25 ° C.	(1) ACD
Dà fhaclan bith-eòlasach	1.00 x 106	Ph 2; Temp: 25 ° C.	(1) ACD
Dà fhaclan bith-eòlasach	1.00 x 106	Ph 3; Temp: 25 ° C.	(1) ACD
Dà fhaclan bith-eòlasach	1.00 x 106	Ph 4; Temp: 25 ° C.	(1) ACD
Dà fhaclan bith-eòlasach	1.00 x 106	Ph 5; Temp: 25 ° C.	(1) ACD
Dà fhaclan bith-eòlasach	1.00 x 106	Ph 6; Temp: 25 ° C.	(1) ACD
Dà fhaclan bith-eòlasach	1.00 x 106	Ph 7; Temp: 25 ° C.	(1) ACD
Dà fhaclan bith-eòlasach	1.00 x 106	Ph 8; Temp: 25 ° C.	(1) ACD
Dà fhaclan bith-eòlasach	1.00 x 106	Ph 9; Temp: 25 ° C.	(1) ACD
Dà fhaclan bith-eòlasach	1.00 x 106	Ph 10; Temp: 25 ° C.	(1) ACD

Ceimigeach

Seilbh	Luach	Suidheachadh	Stòr
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	Ph 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

Seilbh	Luach	Suidheachadh	Stòr
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	Ph 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
Misneachd solbalileachd neo-ghnèitheach mòr	1.2 x 10-5 g / l	Temp: 25 ° C.	(1) ACD
Solbuility mòr	3.5 x 10-3 G / L.	Ph 1; Temp: 25 ° C.	(1) ACD
Solbuility mòr	1.1 x 10-4 G / L	Ph 2; Temp: 25 ° C.	(1) ACD
Solbuility mòr	9.9 x 10-6 G / L	Ph 3; Temp: 25 ° C.	(1) ACD
Solbuility mòr	3.4 X 10-6 G / L	Ph 4; Temp: 25 ° C.	(1) ACD
Solbuility mòr	2.7 x 10-6 G / L	Ph 5; Temp: 25 ° C.	(1) ACD
Solbuility mòr	2.7 x 10-6 G / L	Ph 6; Temp: 25 ° C.	(1) ACD
Solbuility mòr	3.2 x 10-6 G / L.	Ph 7; Temp: 25 ° C.	(1) ACD
Solbuility mòr	8.9 x 10-6 g / l	Ph 8; Temp: 25 ° C.	(1) ACD
Solbuility mòr	6.3 X 10-5 G / L.	Ph 9; Temp: 25 ° C.	(1) ACD
Solbuility mòr	4.2 x 10-4 G / L	Ph 10; Temp: 25 ° C.	(1) ACD
Solbuility mòr	3.2 x 10-6 G / L.	Uisge neo-ainmichte pH 7.00; Temp: 25 ° C.	(1) ACD
Solbalileachd neo-ghnèitheach molar	1.2 x 10-8 Mol / L.	Temp: 25 ° C.	(1) ACD
Solubility molar	3.5 x 10-6 Mol / L.	Ph 1; Temp: 25 ° C.	(1) ACD
Solubility molar	1.1 x 10-7 Mol / L.	Ph 2; Temp: 25 ° C.	(1) ACD
Solubility molar	1.0 x 10-8 Mol / L.	Ph 3; Temp: 25 ° C.	(1) ACD
Solubility molar	3.4 x 10-9 Mol / L.	Ph 4; Temp: 25 ° C.	(1) ACD
Solubility molar	2.7 x 10-9 Mol / L.	Ph 5; Temp: 25 ° C.	(1) ACD
Solubility molar	2.7 x 10-9 Mol / L.	Ph 6; Temp: 25 ° C.	(1) ACD
Solubility molar	3.2 x 10-9 Mol / L.	Ph 7; Temp: 25 ° C.	(1) ACD

Seilbh	Luach	Suidheachadh	Stòr
Solubility molar	9.0 x 10-9 mol / l	Ph 8; Temp: 25 ° C.	(1) ACD
Solubility molar	6.4 x 10-8 Mol / L.	Ph 9; Temp: 25 ° C.	(1) ACD
Solubility molar	4.2 x 10-7 Mol / L.	Ph 10; Temp: 25 ° C.	(1) ACD
Solubility molar	3.2 x 10-9 Mol / L.	Uisge neo-ainmichte pH 7.00; Temp: 25 ° C.	(1) ACD
Cuideam molecular	988.19
paka	7.87 ± 0.43	Temp as searbhagach: 25 ° C.	(1) ACD
paka	3.45 ± 0.70	Temp as bunaitiche: 25 ° C.	(1) ACD

Lipinski

Seilbh	Luach	Suidheachadh	Stòr
Bannan gu tur ro-bheathaichte	21		(1) ACD
Hrrairean	15		(1) ACD
Hnors her	1		(1) ACD
H tabhartaiche / geurraiche suim	16		(1) ACD
logp	11.845 ± 0.715	Temp: 25 ° C.	(1) ACD
Cuideam molecular	988.19