C192H128N8O2S2 — CID 159292400
N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-2-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-4-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-2-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-4-amine (PubChem CID 159292400) has the molecular formula C192H128N8O2S2 and a molecular weight of 2643.32 g/mol. Its IUPAC name is N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-2-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-4-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-2-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-4-amine.
| Compound Name | N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-2-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-4-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-2-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-4-amine |
|---|---|
| PubChem CID | 159292400 |
| Molecular Formula | C192H128N8O2S2 |
| Molecular Weight | 2643.32 g/mol |
| Exact Mass | 2640.96 |
| IUPAC Name | N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-2-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-4-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-2-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-4-amine |
| SMILES | c1ccc(-c2ccc(N(c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)c3ccc4oc5ccccc5c4c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)c3ccc4sc5ccccc5c4c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)c3cccc4c3oc3ccccc34)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)c3cccc4c3sc3ccccc34)cc2)cc1 |
| InChI | InChI=1S/2C48H32N2O.2C48H32N2S/c1-3-12-33(13-4-1)34-22-27-38(28-23-34)49(46-20-11-18-42-41-17-8-10-21-47(41)51-48(42)46)39-29-24-35(25-30-39)36-26-31-45-43(32-36)40-16-7-9-19-44(40)50(45)37-14-5-2-6-15-37;1-3-11-33(12-4-1)34-19-24-38(25-20-34)49(40-28-30-48-44(32-40)42-16-8-10-18-47(42)51-48)39-26-21-35(22-27-39)36-23-29-46-43(31-36)41-15-7-9-17-45(41)50(46)37-13-5-2-6-14-37;1-3-12-33(13-4-1)34-22-27-38(28-23-34)49(46-20-11-18-42-41-17-8-10-21-47(41)51-48(42)46)39-29-24-35(25-30-39)36-26-31-45-43(32-36)40-16-7-9-19-44(40)50(45)37-14-5-2-6-15-37;1-3-11-33(12-4-1)34-19-24-38(25-20-34)49(40-28-30-48-44(32-40)42-16-8-10-18-47(42)51-48)39-26-21-35(22-27-39)36-23-29-46-43(31-36)41-15-7-9-17-45(41)50(46)37-13-5-2-6-14-37/h4*1-32H |
| InChIKey | LAHFOHWCJOBYNZ-UHFFFAOYSA-N |
| XLogP | 54.88 |
| TPSA | 58.96 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 12 |
| Rotatable Bonds | 24 |
| Heavy Atoms | 204 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2643.32 |
| LogP ≤ 5 | 54.88 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 12 |