C184H120N16 — CID 160984950
9-[4-(3,5-diphenylphenyl)-6-(3-naphthalen-2-ylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(3,5-diphenylphenyl)-6-(4-naphthalen-2-ylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(3-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]carbazole (PubChem CID 160984950) has the molecular formula C184H120N16 and a molecular weight of 2555.10 g/mol. Its IUPAC name is 9-[4-(3,5-diphenylphenyl)-6-(3-naphthalen-2-ylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(3,5-diphenylphenyl)-6-(4-naphthalen-2-ylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(3-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]carbazole.
| Compound Name | 9-[4-(3,5-diphenylphenyl)-6-(3-naphthalen-2-ylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(3,5-diphenylphenyl)-6-(4-naphthalen-2-ylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(3-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]carbazole |
|---|---|
| PubChem CID | 160984950 |
| Molecular Formula | C184H120N16 |
| Molecular Weight | 2555.10 g/mol |
| Exact Mass | 2552.99 |
| IUPAC Name | 9-[4-(3,5-diphenylphenyl)-6-(3-naphthalen-2-ylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(3,5-diphenylphenyl)-6-(4-naphthalen-2-ylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(3-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]carbazole |
| SMILES | c1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4ccc(-c5ccc6ccccc6c5)cc4)nc(-n4c5ccccc5c5ccccc54)n3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4cccc(-c5ccc6ccccc6c5)c4)nc(-n4c5ccccc5c5ccccc54)n3)c2)cc1.c1ccc(-c2cccc(-c3nc(-c4ccc(-c5ccc6ccccc6c5)cc4)nc(-n4c5ccccc5c5ccccc54)n3)c2)cc1.c1ccc(-c2cccc(-c3nc(-c4cccc(-c5ccc6ccccc6c5)c4)nc(-n4c5ccccc5c5ccccc54)n3)c2)cc1 |
| InChI | InChI=1S/2C49H32N4.2C43H28N4/c1-3-14-33(15-4-1)40-30-41(34-16-5-2-6-17-34)32-42(31-40)48-50-47(39-21-13-20-37(29-39)38-27-26-35-18-7-8-19-36(35)28-38)51-49(52-48)53-45-24-11-9-22-43(45)44-23-10-12-25-46(44)53;1-3-13-33(14-4-1)40-30-41(34-15-5-2-6-16-34)32-42(31-40)48-50-47(37-26-23-36(24-27-37)39-28-25-35-17-7-8-18-38(35)29-39)51-49(52-48)53-45-21-11-9-19-43(45)44-20-10-12-22-46(44)53;1-2-12-29(13-3-1)32-16-10-18-35(27-32)41-44-42(36-19-11-17-33(28-36)34-25-24-30-14-4-5-15-31(30)26-34)46-43(45-41)47-39-22-8-6-20-37(39)38-21-7-9-23-40(38)47;1-2-11-29(12-3-1)34-15-10-16-36(28-34)42-44-41(32-24-21-31(22-25-32)35-26-23-30-13-4-5-14-33(30)27-35)45-43(46-42)47-39-19-8-6-17-37(39)38-18-7-9-20-40(38)47/h2*1-32H;2*1-28H |
| InChIKey | SZZPTLZLSOTPNA-UHFFFAOYSA-N |
| XLogP | 46.49 |
| TPSA | 174.40 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 16 |
| Rotatable Bonds | 22 |
| Heavy Atoms | 200 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2555.10 |
| LogP ≤ 5 | 46.49 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 16 |