C173H123N15 — CID 165042893
7,7-dimethyl-12-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]indeno[1,2-a]carbazole;7,7-dimethyl-12-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]indeno[1,2-a]carbazole;7,7-dimethyl-12-[4-(4-phenylphenyl)quinazolin-2-yl]indeno[1,2-a]carbazole;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-7,7-dimethyl-3-phenylindeno[1,2-a]carbazole (PubChem CID 165042893) has the molecular formula C173H123N15 and a molecular weight of 2411.99 g/mol. Its IUPAC name is 7,7-dimethyl-12-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]indeno[1,2-a]carbazole;7,7-dimethyl-12-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]indeno[1,2-a]carbazole;7,7-dimethyl-12-[4-(4-phenylphenyl)quinazolin-2-yl]indeno[1,2-a]carbazole;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-7,7-dimethyl-3-phenylindeno[1,2-a]carbazole.
| Compound Name | 7,7-dimethyl-12-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]indeno[1,2-a]carbazole;7,7-dimethyl-12-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]indeno[1,2-a]carbazole;7,7-dimethyl-12-[4-(4-phenylphenyl)quinazolin-2-yl]indeno[1,2-a]carbazole;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-7,7-dimethyl-3-phenylindeno[1,2-a]carbazole |
|---|---|
| PubChem CID | 165042893 |
| Molecular Formula | C173H123N15 |
| Molecular Weight | 2411.99 g/mol |
| Exact Mass | 2410.01 |
| IUPAC Name | 7,7-dimethyl-12-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]indeno[1,2-a]carbazole;7,7-dimethyl-12-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]indeno[1,2-a]carbazole;7,7-dimethyl-12-[4-(4-phenylphenyl)quinazolin-2-yl]indeno[1,2-a]carbazole;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-7,7-dimethyl-3-phenylindeno[1,2-a]carbazole |
| SMILES | CC1(C)c2ccccc2-c2c1ccc1c3cc(-c4ccccc4)ccc3n(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c21.CC1(C)c2ccccc2-c2c1ccc1c3ccccc3n(-c3cccc(-c4nc(-c5ccccc5)nc(-c5ccc(-c6ccccc6)cc5)n4)c3)c21.CC1(C)c2ccccc2-c2c1ccc1c3ccccc3n(-c3nc(-c4ccc(-c5ccccc5)cc4)c4ccccc4n3)c21.CC1(C)c2ccccc2-c2c1ccc1c3ccccc3n(-c3nc(-c4ccccc4)nc(-c4cccc(-c5ccccc5)c4)n3)c21 |
| InChI | InChI=1S/C48H34N4.2C42H30N4.C41H29N3/c1-48(2)40-22-11-9-21-39(40)43-41(48)29-28-38-37-20-10-12-23-42(37)52(44(38)43)36-19-13-18-35(30-36)47-50-45(33-16-7-4-8-17-33)49-46(51-47)34-26-24-32(25-27-34)31-14-5-3-6-15-31;1-42(2)34-21-13-12-20-32(34)37-35(42)24-23-31-33-26-30(27-14-6-3-7-15-27)22-25-36(33)46(38(31)37)41-44-39(28-16-8-4-9-17-28)43-40(45-41)29-18-10-5-11-19-29;1-42(2)34-22-11-9-21-33(34)37-35(42)25-24-32-31-20-10-12-23-36(31)46(38(32)37)41-44-39(28-16-7-4-8-17-28)43-40(45-41)30-19-13-18-29(26-30)27-14-5-3-6-15-27;1-41(2)33-17-9-6-15-31(33)37-34(41)25-24-30-29-14-8-11-19-36(29)44(39(30)37)40-42-35-18-10-7-16-32(35)38(43-40)28-22-20-27(21-23-28)26-12-4-3-5-13-26/h3-30H,1-2H3;2*3-26H,1-2H3;3-25H,1-2H3 |
| InChIKey | OKOVYZBXHBUTAZ-UHFFFAOYSA-N |
| XLogP | 42.86 |
| TPSA | 161.51 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 15 |
| Rotatable Bonds | 16 |
| Heavy Atoms | 188 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2411.99 |
| LogP ≤ 5 | 42.86 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 15 |