C31H32N2N2N2NIn2O8 Urras, 5'-O- [BIS (4-Neach-obrach) -2'-o-Methyl- (ACI) Ìomhaigh chomharraich

C31H32N2N2N2NIn2O8 Urras, 5'-O- [BIS (4-Neach-obrach (O-methyl- (9c I, ACI)

Fiosrachadh bunaiteach:

Cuir post-d thugainn

Mion-fhiosrachadh toraidh

Tagaichean toraidh

Togalaichean corporra

Prìomh thogalaichean corporra	Luach	Suidheachadh
Cuideam molecular	560.60	-
Dùmhlachd (ro-innse)	1.35 ± 0.1 G / cm3	Temp: 20 ° C; Brùth: 760 Torr
paka (ro-innse)	9.39 ± 0.10	Temp as searbhagach: 25 ° C.

Ainmean is aithnichearan eile

Gàire canonical o = c1c = cn (c (= o) n1) C = cc = c = cc = c = cc = c (OC) C = c3) c (O) c2oc
Isomeric SMILES C(OC[C@H]1O[C@H]([C@H](OC)[C@@H]1O)N2C(=O)NC(=O)C=C2)(C3=CC=C(OC)C=C3)(C4=CC=C(OC)C=C4)C5=CC=CC=C5
Inchi
Inchi = 1s / c31H32N2N2NIO8 / C1-3-2-2-5-5-8-5-5-8-5-8-5-8-5-8-5-8-5-8-5-8-5-8-8 (39-25) 29 (41-25)
33-18-18-26 (34) 32-30 (33) 36 / h4-2,36,36-, 27-, 29- / S1
Iuchair Inchi
MFDHAVFJDSRPKCKC-YXINZVNSSA-N
2 ainm eile airson an stuth seo
5'-O- [BIS (4-Bùth-latha-cluiche) dha na Lenylmethyl] -2'-o-methylidine (ACI); 5'-o- (4,4'-dimetoxystrityl) -2'-o-methylidine

Speactra deuchainneach

Spectra ri fhaighinn
1h nmr
Maise

Togalaichean ro-innse

Togalaichean rim faighinn

Bith-eòlasach

Ceimigeach

Dùmhlachd

Lipinski

Structar co-cheangailte

Bith-eòlasach

Seilbh	Luach	Suidheachadh	Stòr
Dà fhaclan bith-eòlasach	1240	Ph 1; Temp: 25 ° C.	(1) ACD
Dà fhaclan bith-eòlasach	1240	Ph 2; Temp: 25 ° C.	(1) ACD
Dà fhaclan bith-eòlasach	1240	Ph 3; Temp: 25 ° C.	(1) ACD
Dà fhaclan bith-eòlasach	1240	Ph 4; Temp: 25 ° C.	(1) ACD
Dà fhaclan bith-eòlasach	1240	Ph 5; Temp: 25 ° C.	(1) ACD
Dà fhaclan bith-eòlasach	1240	Ph 6; Temp: 25 ° C.	(1) ACD
Dà fhaclan bith-eòlasach	1230	Ph 7; Temp: 25 ° C.	(1) ACD
Dà fhaclan bith-eòlasach	1190	Ph 8; Temp: 25 ° C.	(1) ACD
Dà fhaclan bith-eòlasach	861	Ph 9; Temp: 25 ° C.	(1) ACD
Dà fhaclan bith-eòlasach	238	Ph 10; Temp: 25 ° C.	(1) ACD

Ceimigeach

Seilbh	Luach	Suidheachadh	Stòr
Koc	5690	Ph 1; Temp: 25 ° C.	(1) ACD
Koc	5690	Ph 2; Temp: 25 ° C.	(1) ACD
Koc	5690	Ph 3; Temp: 25 ° C.	(1) ACD
Koc	5690	Ph 4; Temp: 25 ° C.	(1) ACD
Koc	5690	Ph 5; Temp: 25 ° C.	(1) ACD
Koc	5690	Ph 6; Temp: 25 ° C.	(1) ACD
Koc	5670	Ph 7; Temp: 25 ° C.	(1) ACD
Koc	5450	Ph 8; Temp: 25 ° C.	(1) ACD

Seilbh	Luach	Suidheachadh	Stòr
Koc	3960	Ph 9; Temp: 25 ° C.	(1) ACD
Koc	1100	Ph 10; Temp: 25 ° C.	(1) ACD
logd	4.37	Ph 1; Temp: 25 ° C.	(1) ACD
logd	4.37	Ph 2; Temp: 25 ° C.	(1) ACD
logd	4.37	Ph 3; Temp: 25 ° C.	(1) ACD
logd	4.37	Ph 4; Temp: 25 ° C.	(1) ACD
logd	4.37	Ph 5; Temp: 25 ° C.	(1) ACD
logd	4.37	Ph 6; Temp: 25 ° C.	(1) ACD
logd	4.37	Ph 7; Temp: 25 ° C.	(1) ACD
logd	4.35	Ph 8; Temp: 25 ° C.	(1) ACD
logd	4.21	Ph 9; Temp: 25 ° C.	(1) ACD
logd	3.66	Ph 10; Temp: 25 ° C.	(1) ACD
logp	4.372 ± 0.582	Temp: 25 ° C.	(1) ACD
Misneachd solbalileachd neo-ghnèitheach mòr	3.7 x 10-4 G / L	Temp: 25 ° C.	(1) ACD
Solbuility mòr	3.7 x 10-4 G / L	Ph 1; Temp: 25 ° C.	(1) ACD
Solbuility mòr	3.7 x 10-4 G / L	Ph 2; Temp: 25 ° C.	(1) ACD
Solbuility mòr	3.7 x 10-4 G / L	Ph 3; Temp: 25 ° C.	(1) ACD
Solbuility mòr	3.7 x 10-4 G / L	Ph 4; Temp: 25 ° C.	(1) ACD
Solbuility mòr	3.7 x 10-4 G / L	Ph 5; Temp: 25 ° C.	(1) ACD
Solbuility mòr	3.7 x 10-4 G / L	Ph 6; Temp: 25 ° C.	(1) ACD
Solbuility mòr	3.7 x 10-4 G / L	Ph 7; Temp: 25 ° C.	(1) ACD
Solbuility mòr	3.8 x 10-4 G / L	Ph 8; Temp: 25 ° C.	(1) ACD
Solbuility mòr	5.3 x 10-4 G / L	Ph 9; Temp: 25 ° C.	(1) ACD
Solbuility mòr	1.9 x 10-3 G / L.	Ph 10; Temp: 25 ° C.	(1) ACD
Solbuility mòr	3.7 x 10-4 G / L	Uisge Unbuffered PH 6.99; Temp: 25 ° C.	(1) ACD
Solbalileachd neo-ghnèitheach molar	6.6 x 10-7 Mol / L.	Temp: 25 ° C.	(1) ACD
Solubility molar	6.6 x 10-7 Mol / L.	Ph 1; Temp: 25 ° C.	(1) ACD
Solubility molar	6.6 x 10-7 Mol / L.	Ph 2; Temp: 25 ° C.	(1) ACD
Solubility molar	6.6 x 10-7 Mol / L.	Ph 3; Temp: 25 ° C.	(1) ACD
Solubility molar	6.6 x 10-7 Mol / L.	Ph 4; Temp: 25 ° C.	(1) ACD
Solubility molar	6.6 x 10-7 Mol / L.	Ph 5; Temp: 25 ° C.	(1) ACD
Solubility molar	6.6 x 10-7 Mol / L.	Ph 6; Temp: 25 ° C.	(1) ACD

Seilbh	Luach	Suidheachadh	Stòr
Solubility molar	6.6 x 10-7 Mol / L.	Ph 7; Temp: 25 ° C.	(1) ACD
Solubility molar	6.8 x 10-7 Mol / L.	Ph 8; Temp: 25 ° C.	(1) ACD
Solubility molar	9.4 x 10-7 Mol / L.	Ph 9; Temp: 25 ° C.	(1) ACD
Solubility molar	3.4 x 10-6 Mol / L.	Ph 10; Temp: 25 ° C.	(1) ACD
Solubility molar	6.6 x 10-7 Mol / L.	Uisge Unbuffered PH 6.99; Temp: 25 ° C.	(1) ACD
Cuideam molecular	560.60
paka	9.39 ± 0.10	Temp as searbhagach: 25 ° C.	(1) ACD

Dùmhlachd

Seilbh	Luach	Suidheachadh	Stòr
Dùmhlachd	1.35 ± 0.1 G / cm3	Temp: 20 ° C; Brùth: 760 Torr	(1) ACD
Tomhas-lìonaidh molar	412.9 ± 5.0 cm3 / mol	Temp: 20 ° C; Brùth: 760 Torr	(1) ACD

Lipinski

Seilbh	Luach	Suidheachadh	Stòr
Bannan gu tur ro-bheathaichte	11		(1) ACD
Hrrairean	10		(1) ACD
Hnors her	2		(1) ACD
H tabhartaiche / geurraiche suim	12		(1) ACD
logp	4.372 ± 0.582	Temp: 25 ° C.	(1) ACD
Cuideam molecular	560.60