C146H91N15 — CID 161358691
5,12-bis(5-phenylpyrido[4,3-b]indol-8-yl)indolo[3,2-c]carbazole;5-(9-phenylcarbazol-3-yl)-12-(5-phenylpyrido[4,3-b]indol-8-yl)indolo[3,2-c]carbazole;5-phenyl-12-(4-pyrido[4,3-b]indol-5-ylphenyl)indolo[3,2-c]carbazole (PubChem CID 161358691) has the molecular formula C146H91N15 and a molecular weight of 2055.44 g/mol. Its IUPAC name is 5,12-bis(5-phenylpyrido[4,3-b]indol-8-yl)indolo[3,2-c]carbazole;5-(9-phenylcarbazol-3-yl)-12-(5-phenylpyrido[4,3-b]indol-8-yl)indolo[3,2-c]carbazole;5-phenyl-12-(4-pyrido[4,3-b]indol-5-ylphenyl)indolo[3,2-c]carbazole.
| Compound Name | 5,12-bis(5-phenylpyrido[4,3-b]indol-8-yl)indolo[3,2-c]carbazole;5-(9-phenylcarbazol-3-yl)-12-(5-phenylpyrido[4,3-b]indol-8-yl)indolo[3,2-c]carbazole;5-phenyl-12-(4-pyrido[4,3-b]indol-5-ylphenyl)indolo[3,2-c]carbazole |
|---|---|
| PubChem CID | 161358691 |
| Molecular Formula | C146H91N15 |
| Molecular Weight | 2055.44 g/mol |
| Exact Mass | 2053.76 |
| IUPAC Name | 5,12-bis(5-phenylpyrido[4,3-b]indol-8-yl)indolo[3,2-c]carbazole;5-(9-phenylcarbazol-3-yl)-12-(5-phenylpyrido[4,3-b]indol-8-yl)indolo[3,2-c]carbazole;5-phenyl-12-(4-pyrido[4,3-b]indol-5-ylphenyl)indolo[3,2-c]carbazole |
| SMILES | c1ccc(-n2c3ccccc3c3c2ccc2c4ccccc4n(-c4ccc(-n5c6ccccc6c6cnccc65)cc4)c23)cc1.c1ccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5c4ccc4c6ccccc6n(-c6ccc7c(c6)c6cnccc6n7-c6ccccc6)c45)ccc32)cc1.c1ccc(-n2c3ccncc3c3cc(-n4c5ccccc5c5c4ccc4c6ccccc6n(-c6ccc7c(c6)c6cnccc6n7-c6ccccc6)c45)ccc32)cc1 |
| InChI | InChI=1S/C53H33N5.C52H32N6.C41H26N4/c1-3-13-34(14-4-1)55-45-20-10-8-18-39(45)42-31-36(23-26-48(42)55)57-47-22-12-9-19-41(47)52-51(57)28-25-40-38-17-7-11-21-46(38)58(53(40)52)37-24-27-49-43(32-37)44-33-54-30-29-50(44)56(49)35-15-5-2-6-16-35;1-3-11-33(12-4-1)55-46-22-19-35(29-40(46)42-31-53-27-25-48(42)55)57-45-18-10-8-16-39(45)51-50(57)24-21-38-37-15-7-9-17-44(37)58(52(38)51)36-20-23-47-41(30-36)43-32-54-28-26-49(43)56(47)34-13-5-2-6-14-34;1-2-10-27(11-3-1)44-37-17-9-6-14-33(37)40-39(44)23-22-32-30-12-4-8-16-36(30)45(41(32)40)29-20-18-28(19-21-29)43-35-15-7-5-13-31(35)34-26-42-25-24-38(34)43/h1-33H;1-32H;1-26H |
| InChIKey | VOWQCRAHIUVJFG-UHFFFAOYSA-N |
| XLogP | 36.71 |
| TPSA | 105.79 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 15 |
| Rotatable Bonds | 11 |
| Heavy Atoms | 161 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2055.44 |
| LogP ≤ 5 | 36.71 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 15 |