C138H92N6 — CID 167636301
12-(3,5-diphenylphenyl)-5-phenylindolo[3,2-c]carbazole;12-(3,5-diphenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(3,5-diphenylphenyl)phenyl]-5-phenylindolo[3,2-c]carbazole (PubChem CID 167636301) has the molecular formula C138H92N6 and a molecular weight of 1834.30 g/mol. Its IUPAC name is 12-(3,5-diphenylphenyl)-5-phenylindolo[3,2-c]carbazole;12-(3,5-diphenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(3,5-diphenylphenyl)phenyl]-5-phenylindolo[3,2-c]carbazole.
| Compound Name | 12-(3,5-diphenylphenyl)-5-phenylindolo[3,2-c]carbazole;12-(3,5-diphenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(3,5-diphenylphenyl)phenyl]-5-phenylindolo[3,2-c]carbazole |
|---|---|
| PubChem CID | 167636301 |
| Molecular Formula | C138H92N6 |
| Molecular Weight | 1834.30 g/mol |
| Exact Mass | 1832.74 |
| IUPAC Name | 12-(3,5-diphenylphenyl)-5-phenylindolo[3,2-c]carbazole;12-(3,5-diphenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(3,5-diphenylphenyl)phenyl]-5-phenylindolo[3,2-c]carbazole |
| SMILES | c1ccc(-c2cc(-c3ccccc3)cc(-c3ccc(-n4c5ccccc5c5ccc6c(c7ccccc7n6-c6ccccc6)c54)cc3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5ccccc5)c43)c2)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)c34)cc2)cc1 |
| InChI | InChI=1S/2C48H32N2.C42H28N2/c1-4-14-33(15-5-1)36-30-37(34-16-6-2-7-17-34)32-38(31-36)35-24-26-40(27-25-35)50-44-22-12-10-20-41(44)42-28-29-46-47(48(42)50)43-21-11-13-23-45(43)49(46)39-18-8-3-9-19-39;1-4-14-33(15-5-1)36-24-26-39(27-25-36)49-45-23-13-11-21-43(45)47-46(49)29-28-42-41-20-10-12-22-44(41)50(48(42)47)40-31-37(34-16-6-2-7-17-34)30-38(32-40)35-18-8-3-9-19-35;1-4-14-29(15-5-1)31-26-32(30-16-6-2-7-17-30)28-34(27-31)44-38-22-12-10-20-35(38)36-24-25-40-41(42(36)44)37-21-11-13-23-39(37)43(40)33-18-8-3-9-19-33/h2*1-32H;1-28H |
| InChIKey | ONHDAFITLZQXRX-UHFFFAOYSA-N |
| XLogP | 36.98 |
| TPSA | 29.58 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 14 |
| Heavy Atoms | 144 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1834.30 |
| LogP ≤ 5 | 36.98 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 6 |