C164H116N6 — CID 157263166
N-naphthalen-1-yl-9-phenyl-N-[3-(1,2,2-triphenylethenyl)phenyl]carbazol-1-amine;N-naphthalen-2-yl-9-phenyl-N-[2-(1,2,2-triphenylethenyl)phenyl]carbazol-2-amine;9-phenyl-N-(4-phenylphenyl)-N-[2-(1,2,2-triphenylethenyl)phenyl]carbazol-2-amine (PubChem CID 157263166) has the molecular formula C164H116N6 and a molecular weight of 2170.77 g/mol. Its IUPAC name is N-naphthalen-1-yl-9-phenyl-N-[3-(1,2,2-triphenylethenyl)phenyl]carbazol-1-amine;N-naphthalen-2-yl-9-phenyl-N-[2-(1,2,2-triphenylethenyl)phenyl]carbazol-2-amine;9-phenyl-N-(4-phenylphenyl)-N-[2-(1,2,2-triphenylethenyl)phenyl]carbazol-2-amine.
| Compound Name | N-naphthalen-1-yl-9-phenyl-N-[3-(1,2,2-triphenylethenyl)phenyl]carbazol-1-amine;N-naphthalen-2-yl-9-phenyl-N-[2-(1,2,2-triphenylethenyl)phenyl]carbazol-2-amine;9-phenyl-N-(4-phenylphenyl)-N-[2-(1,2,2-triphenylethenyl)phenyl]carbazol-2-amine |
|---|---|
| PubChem CID | 157263166 |
| Molecular Formula | C164H116N6 |
| Molecular Weight | 2170.77 g/mol |
| Exact Mass | 2168.93 |
| IUPAC Name | N-naphthalen-1-yl-9-phenyl-N-[3-(1,2,2-triphenylethenyl)phenyl]carbazol-1-amine;N-naphthalen-2-yl-9-phenyl-N-[2-(1,2,2-triphenylethenyl)phenyl]carbazol-2-amine;9-phenyl-N-(4-phenylphenyl)-N-[2-(1,2,2-triphenylethenyl)phenyl]carbazol-2-amine |
| SMILES | c1ccc(C(=C(c2ccccc2)c2cccc(N(c3cccc4ccccc34)c3cccc4c5ccccc5n(-c5ccccc5)c34)c2)c2ccccc2)cc1.c1ccc(C(=C(c2ccccc2)c2ccccc2N(c2ccc(-c3ccccc3)cc2)c2ccc3c4ccccc4n(-c4ccccc4)c3c2)c2ccccc2)cc1.c1ccc(C(=C(c2ccccc2)c2ccccc2N(c2ccc3ccccc3c2)c2ccc3c4ccccc4n(-c4ccccc4)c3c2)c2ccccc2)cc1 |
| InChI | InChI=1S/C56H40N2.2C54H38N2/c1-6-20-41(21-7-1)42-34-36-47(37-35-42)57(48-38-39-50-49-30-16-18-32-52(49)58(54(50)40-48)46-28-14-5-15-29-46)53-33-19-17-31-51(53)56(45-26-12-4-13-27-45)55(43-22-8-2-9-23-43)44-24-10-3-11-25-44;1-5-20-40(21-6-1)53(41-22-7-2-8-23-41)54(42-24-9-3-10-25-42)49-30-16-18-32-51(49)55(45-34-33-39-19-13-14-26-43(39)37-45)46-35-36-48-47-29-15-17-31-50(47)56(52(48)38-46)44-27-11-4-12-28-44;1-5-21-40(22-6-1)52(41-23-7-2-8-24-41)53(42-25-9-3-10-26-42)43-28-17-31-45(38-43)55(49-36-18-27-39-20-13-14-32-46(39)49)51-37-19-34-48-47-33-15-16-35-50(47)56(54(48)51)44-29-11-4-12-30-44/h1-40H;2*1-38H |
| InChIKey | AXRUUINICCSKPS-UHFFFAOYSA-N |
| XLogP | 43.76 |
| TPSA | 24.51 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 25 |
| Heavy Atoms | 170 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2170.77 |
| LogP ≤ 5 | 43.76 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 6 |
| Structural Alerts | {'alert_name': 'stilbene', 'substructure': 'N/A'} |
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