C274H191N5O10Si5 — CID 162076090
N-[4-(6'-cyclohexyl-10,10'-spirobi[benzo[b][1,4]benzoxasiline]-2'-yl)phenyl]-N,4-diphenylaniline;N,7-diphenyl-N-(4-phenylphenyl)-10,10'-spirobi[benzo[b][1,4]benzoxasiline]-2-amine;N-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)-8'-phenyl-10,10'-spirobi[benzo[b][1,4]benzoxasiline]-2'-amine;N-naphthalen-1-yl-N-(4-phenylphenyl)-4-(10,10'-spirobi[benzo[b][1,4]benzoxasiline]-2-yl)naphthalen-1-amine;N-phenyl-N-[4-(4-phenylphenyl)phenyl]-3-[4-(10,10'-spirobi[benzo[b][1,4]benzoxasiline]-2-yl)phenyl]aniline (PubChem CID 162076090) has the molecular formula C274H191N5O10Si5 and a molecular weight of 3854.00 g/mol. Its IUPAC name is N-[4-(6'-cyclohexyl-10,10'-spirobi[benzo[b][1,4]benzoxasiline]-2'-yl)phenyl]-N,4-diphenylaniline;N,7-diphenyl-N-(4-phenylphenyl)-10,10'-spirobi[benzo[b][1,4]benzoxasiline]-2-amine;N-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)-8'-phenyl-10,10'-spirobi[benzo[b][1,4]benzoxasiline]-2'-amine;N-naphthalen-1-yl-N-(4-phenylphenyl)-4-(10,10'-spirobi[benzo[b][1,4]benzoxasiline]-2-yl)naphthalen-1-amine;N-phenyl-N-[4-(4-phenylphenyl)phenyl]-3-[4-(10,10'-spirobi[benzo[b][1,4]benzoxasiline]-2-yl)phenyl]aniline.
| Compound Name | N-[4-(6'-cyclohexyl-10,10'-spirobi[benzo[b][1,4]benzoxasiline]-2'-yl)phenyl]-N,4-diphenylaniline;N,7-diphenyl-N-(4-phenylphenyl)-10,10'-spirobi[benzo[b][1,4]benzoxasiline]-2-amine;N-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)-8'-phenyl-10,10'-spirobi[benzo[b][1,4]benzoxasiline]-2'-amine;N-naphthalen-1-yl-N-(4-phenylphenyl)-4-(10,10'-spirobi[benzo[b][1,4]benzoxasiline]-2-yl)naphthalen-1-amine;N-phenyl-N-[4-(4-phenylphenyl)phenyl]-3-[4-(10,10'-spirobi[benzo[b][1,4]benzoxasiline]-2-yl)phenyl]aniline |
|---|---|
| PubChem CID | 162076090 |
| Molecular Formula | C274H191N5O10Si5 |
| Molecular Weight | 3854.00 g/mol |
| Exact Mass | 3850.34 |
| IUPAC Name | N-[4-(6'-cyclohexyl-10,10'-spirobi[benzo[b][1,4]benzoxasiline]-2'-yl)phenyl]-N,4-diphenylaniline;N,7-diphenyl-N-(4-phenylphenyl)-10,10'-spirobi[benzo[b][1,4]benzoxasiline]-2-amine;N-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)-8'-phenyl-10,10'-spirobi[benzo[b][1,4]benzoxasiline]-2'-amine;N-naphthalen-1-yl-N-(4-phenylphenyl)-4-(10,10'-spirobi[benzo[b][1,4]benzoxasiline]-2-yl)naphthalen-1-amine;N-phenyl-N-[4-(4-phenylphenyl)phenyl]-3-[4-(10,10'-spirobi[benzo[b][1,4]benzoxasiline]-2-yl)phenyl]aniline |
| SMILES | c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4cccc(-c5ccc(-c6ccc7c(c6)[Si]6(c8ccccc8Oc8ccccc86)c6ccccc6O7)cc5)c4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3cccc4ccccc34)c3ccc(-c4ccc5c(c4)[Si]4(c6ccccc6Oc6ccccc64)c4ccccc4O5)c4ccccc34)cc2)cc1.c1ccc(-c2ccc(N(c3ccccc3)c3ccc(-c4ccc5c(c4)[Si]4(c6ccccc6Oc6ccccc64)c4cccc(C6CCCCC6)c4O5)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccccc3)c3ccc4c(c3)[Si]3(c5ccccc5Oc5ccccc53)c3ccc(-c5ccccc5)cc3O4)cc2)cc1.c1ccc(-c2ccc3c(c2)[Si]2(c4ccccc4Oc4ccccc42)c2cc(N(c4ccc(-c5cccc6ccccc56)cc4)c4cccc5ccccc45)ccc2O3)cc1 |
| InChI | InChI=1S/C60H41NO2Si.2C56H37NO2Si.C54H43NO2Si.C48H33NO2Si/c1-3-14-42(15-4-1)43-26-28-44(29-27-43)45-34-37-51(38-35-45)61(50-17-5-2-6-18-50)52-19-13-16-48(40-52)46-30-32-47(33-31-46)49-36-39-56-60(41-49)64(59-25-12-9-22-55(59)63-56)57-23-10-7-20-53(57)62-54-21-8-11-24-58(54)64;1-2-14-38(15-3-1)42-30-34-51-55(36-42)60(53-26-10-8-24-49(53)58-50-25-9-11-27-54(50)60)56-37-44(33-35-52(56)59-51)57(48-23-13-19-40-17-5-7-21-47(40)48)43-31-28-41(29-32-43)46-22-12-18-39-16-4-6-20-45(39)46;1-2-15-38(16-3-1)39-29-32-42(33-30-39)57(47-22-14-18-40-17-4-5-19-44(40)47)48-35-34-43(45-20-6-7-21-46(45)48)41-31-36-52-56(37-41)60(55-28-13-10-25-51(55)59-52)53-26-11-8-23-49(53)58-50-24-9-12-27-54(50)60;1-4-15-38(16-5-1)39-27-32-44(33-28-39)55(43-19-8-3-9-20-43)45-34-29-40(30-35-45)42-31-36-49-53(37-42)58(50-24-12-10-22-47(50)56-48-23-11-13-25-51(48)58)52-26-14-21-46(54(52)57-49)41-17-6-2-7-18-41;1-4-14-34(15-5-1)36-24-27-39(28-25-36)49(38-18-8-3-9-19-38)40-29-30-43-48(33-40)52(45-22-12-10-20-41(45)50-42-21-11-13-23-46(42)52)47-31-26-37(32-44(47)51-43)35-16-6-2-7-17-35/h1-41H;2*1-37H;1,3-5,8-16,19-37,41H,2,6-7,17-18H2;1-33H |
| InChIKey | ZBSKPADVYKMTGC-UHFFFAOYSA-N |
| XLogP | 60.39 |
| TPSA | 108.50 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 15 |
| Rotatable Bonds | 28 |
| Heavy Atoms | 294 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3854.00 |
| LogP ≤ 5 | 60.39 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 15 |