C144H95N15 — CID 160751175
9-(benzimidazolo[1,2-c]quinazolin-6-yl)-N,N-bis(4-phenylphenyl)carbazol-2-amine;4-[9-(benzimidazolo[1,2-c]quinazolin-6-yl)carbazol-2-yl]-N,N-diphenylaniline;N-[4-[9-(benzimidazolo[1,2-c]quinazolin-6-yl)carbazol-2-yl]phenyl]-N,4-diphenylaniline (PubChem CID 160751175) has the molecular formula C144H95N15 and a molecular weight of 2035.45 g/mol. Its IUPAC name is 9-(benzimidazolo[1,2-c]quinazolin-6-yl)-N,N-bis(4-phenylphenyl)carbazol-2-amine;4-[9-(benzimidazolo[1,2-c]quinazolin-6-yl)carbazol-2-yl]-N,N-diphenylaniline;N-[4-[9-(benzimidazolo[1,2-c]quinazolin-6-yl)carbazol-2-yl]phenyl]-N,4-diphenylaniline.
| Compound Name | 9-(benzimidazolo[1,2-c]quinazolin-6-yl)-N,N-bis(4-phenylphenyl)carbazol-2-amine;4-[9-(benzimidazolo[1,2-c]quinazolin-6-yl)carbazol-2-yl]-N,N-diphenylaniline;N-[4-[9-(benzimidazolo[1,2-c]quinazolin-6-yl)carbazol-2-yl]phenyl]-N,4-diphenylaniline |
|---|---|
| PubChem CID | 160751175 |
| Molecular Formula | C144H95N15 |
| Molecular Weight | 2035.45 g/mol |
| Exact Mass | 2033.79 |
| IUPAC Name | 9-(benzimidazolo[1,2-c]quinazolin-6-yl)-N,N-bis(4-phenylphenyl)carbazol-2-amine;4-[9-(benzimidazolo[1,2-c]quinazolin-6-yl)carbazol-2-yl]-N,N-diphenylaniline;N-[4-[9-(benzimidazolo[1,2-c]quinazolin-6-yl)carbazol-2-yl]phenyl]-N,4-diphenylaniline |
| SMILES | c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c5ccccc5n(-c5nc6ccccc6c6nc7ccccc7n56)c4c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccccc3)c3ccc(-c4ccc5c6ccccc6n(-c6nc7ccccc7c7nc8ccccc8n67)c5c4)cc3)cc2)cc1.c1ccc(N(c2ccccc2)c2ccc(-c3ccc4c5ccccc5n(-c5nc6ccccc6c6nc7ccccc7n56)c4c3)cc2)cc1 |
| InChI | InChI=1S/2C50H33N5.C44H29N5/c1-3-13-34(14-4-1)35-23-28-39(29-24-35)53(38-15-5-2-6-16-38)40-30-25-36(26-31-40)37-27-32-42-41-17-8-11-21-46(41)54(48(42)33-37)50-52-44-19-9-7-18-43(44)49-51-45-20-10-12-22-47(45)55(49)50;1-3-13-34(14-4-1)36-23-27-38(28-24-36)53(39-29-25-37(26-30-39)35-15-5-2-6-16-35)40-31-32-42-41-17-8-11-21-46(41)54(48(42)33-40)50-52-44-19-9-7-18-43(44)49-51-45-20-10-12-22-47(45)55(49)50;1-3-13-32(14-4-1)47(33-15-5-2-6-16-33)34-26-23-30(24-27-34)31-25-28-36-35-17-8-11-21-40(35)48(42(36)29-31)44-46-38-19-9-7-18-37(38)43-45-39-20-10-12-22-41(39)49(43)44/h2*1-33H;1-29H |
| InChIKey | RWVKTQOYBLEKMO-UHFFFAOYSA-N |
| XLogP | 37.14 |
| TPSA | 115.08 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 15 |
| Rotatable Bonds | 17 |
| Heavy Atoms | 159 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2035.45 |
| LogP ≤ 5 | 37.14 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 15 |