C153H97N15O — CID 162005226
12-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)-5-(3,5-diphenylphenyl)indolo[3,2-c]carbazole;12-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-(4-phenylphenyl)indolo[3,2-c]carbazole;5-phenyl-12-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[3,2-c]carbazole (PubChem CID 162005226) has the molecular formula C153H97N15O and a molecular weight of 2161.56 g/mol. Its IUPAC name is 12-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)-5-(3,5-diphenylphenyl)indolo[3,2-c]carbazole;12-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-(4-phenylphenyl)indolo[3,2-c]carbazole;5-phenyl-12-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[3,2-c]carbazole.
| Compound Name | 12-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)-5-(3,5-diphenylphenyl)indolo[3,2-c]carbazole;12-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-(4-phenylphenyl)indolo[3,2-c]carbazole;5-phenyl-12-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[3,2-c]carbazole |
|---|---|
| PubChem CID | 162005226 |
| Molecular Formula | C153H97N15O |
| Molecular Weight | 2161.56 g/mol |
| Exact Mass | 2159.80 |
| IUPAC Name | 12-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)-5-(3,5-diphenylphenyl)indolo[3,2-c]carbazole;12-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-(4-phenylphenyl)indolo[3,2-c]carbazole;5-phenyl-12-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[3,2-c]carbazole |
| SMILES | c1ccc(-c2cc(-c3ccccc3)cc(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5nc(-c6ccccc6)nc(-c6ccc7c(c6)oc6ccccc67)n5)c34)c2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-n4c5ccccc5c5ccc6c(c7ccccc7n6-c6ccccc6)c54)n3)cc2)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5ccc(-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)cc5)c34)cc2)cc1 |
| InChI | InChI=1S/C57H35N5O.C51H33N5.C45H29N5/c1-4-16-36(17-5-1)40-32-41(37-18-6-2-7-19-37)34-42(33-40)61-49-26-14-11-24-47(49)53-50(61)31-30-46-43-22-10-13-25-48(43)62(54(46)53)57-59-55(38-20-8-3-9-21-38)58-56(60-57)39-28-29-45-44-23-12-15-27-51(44)63-52(45)35-39;1-4-14-34(15-5-1)35-24-28-39(29-25-35)55-45-23-13-11-21-43(45)47-46(55)33-32-42-41-20-10-12-22-44(41)56(48(42)47)40-30-26-38(27-31-40)51-53-49(36-16-6-2-7-17-36)52-50(54-51)37-18-8-3-9-19-37;1-4-14-30(15-5-1)31-24-26-33(27-25-31)44-46-43(32-16-6-2-7-17-32)47-45(48-44)50-38-22-12-10-20-35(38)36-28-29-40-41(42(36)50)37-21-11-13-23-39(37)49(40)34-18-8-3-9-19-34/h1-35H;1-33H;1-29H |
| InChIKey | YSSYWXXVNOBAPZ-UHFFFAOYSA-N |
| XLogP | 38.43 |
| TPSA | 158.73 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 16 |
| Rotatable Bonds | 17 |
| Heavy Atoms | 169 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2161.56 |
| LogP ≤ 5 | 38.43 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 16 |