C143H116N6Si — CID 161157540
N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-5,5-dimethyl-N-(4-phenylphenyl)benzo[b][1]benzosilol-3-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline (PubChem CID 161157540) has the molecular formula C143H116N6Si and a molecular weight of 1946.63 g/mol. Its IUPAC name is N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-5,5-dimethyl-N-(4-phenylphenyl)benzo[b][1]benzosilol-3-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline.
| Compound Name | N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-5,5-dimethyl-N-(4-phenylphenyl)benzo[b][1]benzosilol-3-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline |
|---|---|
| PubChem CID | 161157540 |
| Molecular Formula | C143H116N6Si |
| Molecular Weight | 1946.63 g/mol |
| Exact Mass | 1944.90 |
| IUPAC Name | N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-5,5-dimethyl-N-(4-phenylphenyl)benzo[b][1]benzosilol-3-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[4-(2,3-dimethylindol-1-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline |
| SMILES | Cc1c(C)n(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)cc3)cc2)c2ccccc12.Cc1c(C)n(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc5c(c4)C(C)(C)c4ccccc4-5)cc3)cc2)c2ccccc12.Cc1c(C)n(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc5c(c4)[Si](C)(C)c4ccccc4-5)cc3)cc2)c2ccccc12 |
| InChI | InChI=1S/C49H40N2.C48H40N2Si.C46H36N2/c1-33-34(2)50(48-17-11-9-14-43(33)48)39-24-18-37(19-25-39)38-22-28-41(29-23-38)51(40-26-20-36(21-27-40)35-12-6-5-7-13-35)42-30-31-45-44-15-8-10-16-46(44)49(3,4)47(45)32-42;1-33-34(2)49(46-16-10-8-14-43(33)46)39-24-18-37(19-25-39)38-22-28-41(29-23-38)50(40-26-20-36(21-27-40)35-12-6-5-7-13-35)42-30-31-45-44-15-9-11-17-47(44)51(3,4)48(45)32-42;1-33-34(2)47(46-16-10-9-15-45(33)46)41-25-17-39(18-26-41)40-23-31-44(32-24-40)48(42-27-19-37(20-28-42)35-11-5-3-6-12-35)43-29-21-38(22-30-43)36-13-7-4-8-14-36/h2*5-32H,1-4H3;3-32H,1-2H3 |
| InChIKey | UPMLXDHIZQBTOJ-UHFFFAOYSA-N |
| XLogP | 37.93 |
| TPSA | 24.51 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 19 |
| Heavy Atoms | 150 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1946.63 |
| LogP ≤ 5 | 37.93 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 6 |
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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