C210H136N16 — CID 158523648
12-[2-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]-5-phenylindolo[3,2-c]carbazole;5-phenyl-12-[2-[2-phenyl-6-(3-phenylphenyl)-4-pyridinyl]phenyl]indolo[3,2-c]carbazole;5-phenyl-12-[2-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]phenyl]indolo[3,2-c]carbazole;5-phenyl-12-[2-[6-phenyl-2-(2-phenylphenyl)pyrimidin-4-yl]phenyl]indolo[3,2-c]carbazole (PubChem CID 158523648) has the molecular formula C210H136N16 and a molecular weight of 2883.51 g/mol. Its IUPAC name is 12-[2-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]-5-phenylindolo[3,2-c]carbazole;5-phenyl-12-[2-[2-phenyl-6-(3-phenylphenyl)-4-pyridinyl]phenyl]indolo[3,2-c]carbazole;5-phenyl-12-[2-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]phenyl]indolo[3,2-c]carbazole;5-phenyl-12-[2-[6-phenyl-2-(2-phenylphenyl)pyrimidin-4-yl]phenyl]indolo[3,2-c]carbazole.
| Compound Name | 12-[2-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]-5-phenylindolo[3,2-c]carbazole;5-phenyl-12-[2-[2-phenyl-6-(3-phenylphenyl)-4-pyridinyl]phenyl]indolo[3,2-c]carbazole;5-phenyl-12-[2-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]phenyl]indolo[3,2-c]carbazole;5-phenyl-12-[2-[6-phenyl-2-(2-phenylphenyl)pyrimidin-4-yl]phenyl]indolo[3,2-c]carbazole |
|---|---|
| PubChem CID | 158523648 |
| Molecular Formula | C210H136N16 |
| Molecular Weight | 2883.51 g/mol |
| Exact Mass | 2881.11 |
| IUPAC Name | 12-[2-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]-5-phenylindolo[3,2-c]carbazole;5-phenyl-12-[2-[2-phenyl-6-(3-phenylphenyl)-4-pyridinyl]phenyl]indolo[3,2-c]carbazole;5-phenyl-12-[2-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]phenyl]indolo[3,2-c]carbazole;5-phenyl-12-[2-[6-phenyl-2-(2-phenylphenyl)pyrimidin-4-yl]phenyl]indolo[3,2-c]carbazole |
| SMILES | c1ccc(-c2cc(-c3ccccc3-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5ccccc5)c43)nc(-c3ccccc3-c3ccccc3)n2)cc1.c1ccc(-c2cccc(-c3cc(-c4ccccc4)nc(-c4ccccc4-n4c5ccccc5c5ccc6c(c7ccccc7n6-c6ccccc6)c54)n3)c2)cc1.c1ccc(-c2cccc(-c3cc(-c4ccccc4-n4c5ccccc5c5ccc6c(c7ccccc7n6-c6ccccc6)c54)cc(-c4ccccc4)n3)c2)cc1.c1ccc(-n2c3ccccc3c3c2ccc2c4ccccc4n(-c4ccccc4-c4nc(-c5ccc6ccccc6c5)nc(-c5ccc6ccccc6c5)n4)c23)cc1 |
| InChI | InChI=1S/C53H33N5.C53H35N3.2C52H34N4/c1-2-18-40(19-3-1)57-46-24-12-9-21-43(46)49-48(57)31-30-42-41-20-8-11-23-45(41)58(50(42)49)47-25-13-10-22-44(47)53-55-51(38-28-26-34-14-4-6-16-36(34)32-38)54-52(56-53)39-29-27-35-15-5-7-17-37(35)33-39;1-4-17-36(18-5-1)38-21-16-22-39(33-38)47-35-40(34-46(54-47)37-19-6-2-7-20-37)42-25-10-13-28-48(42)56-49-29-14-11-26-43(49)44-31-32-51-52(53(44)56)45-27-12-15-30-50(45)55(51)41-23-8-3-9-24-41;1-4-17-35(18-5-1)37-21-16-22-38(33-37)45-34-44(36-19-6-2-7-20-36)53-52(54-45)43-27-12-15-30-48(43)56-46-28-13-10-25-40(46)41-31-32-49-50(51(41)56)42-26-11-14-29-47(42)55(49)39-23-8-3-9-24-39;1-4-18-35(19-5-1)38-24-10-11-26-41(38)52-53-44(36-20-6-2-7-21-36)34-45(54-52)42-27-13-16-30-47(42)56-46-29-15-12-25-39(46)40-32-33-49-50(51(40)56)43-28-14-17-31-48(43)55(49)37-22-8-3-9-23-37/h1-33H;1-35H;2*1-34H |
| InChIKey | HMNGOZNQLQOLFH-UHFFFAOYSA-N |
| XLogP | 53.99 |
| TPSA | 142.56 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 16 |
| Rotatable Bonds | 23 |
| Heavy Atoms | 226 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2883.51 |
| LogP ≤ 5 | 53.99 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 16 |