C162H106N12 — CID 165085308
2,4-dinaphthalen-2-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(3,5-diphenylphenyl)-4-naphthalen-1-yl-6-naphthalen-2-yl-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-[4-(4-naphthalen-1-ylphenyl)phenyl]-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazine (PubChem CID 165085308) has the molecular formula C162H106N12 and a molecular weight of 2220.71 g/mol. Its IUPAC name is 2,4-dinaphthalen-2-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(3,5-diphenylphenyl)-4-naphthalen-1-yl-6-naphthalen-2-yl-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-[4-(4-naphthalen-1-ylphenyl)phenyl]-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazine.
| Compound Name | 2,4-dinaphthalen-2-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(3,5-diphenylphenyl)-4-naphthalen-1-yl-6-naphthalen-2-yl-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-[4-(4-naphthalen-1-ylphenyl)phenyl]-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazine |
|---|---|
| PubChem CID | 165085308 |
| Molecular Formula | C162H106N12 |
| Molecular Weight | 2220.71 g/mol |
| Exact Mass | 2218.87 |
| IUPAC Name | 2,4-dinaphthalen-2-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(3,5-diphenylphenyl)-4-naphthalen-1-yl-6-naphthalen-2-yl-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-[4-(4-naphthalen-1-ylphenyl)phenyl]-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazine |
| SMILES | c1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4ccc5ccccc5c4)nc(-c4cccc5ccccc45)n3)c2)cc1.c1ccc(-c2ccc(-c3ccc(-c4nc(-c5ccc6ccccc6c5)nc(-c5cccc6ccccc56)n4)cc3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccc5ccccc5c4)nc(-c4ccc5ccccc5c4)n3)cc2)cc1.c1ccc2cc(-c3nc(-c4ccc(-c5ccc(-c6cccc7ccccc67)cc5)cc4)nc(-c4cccc5ccccc45)n3)ccc2c1 |
| InChI | InChI=1S/C45H29N3.2C41H27N3.C35H23N3/c1-2-12-37-29-38(28-23-30(37)9-1)44-46-43(47-45(48-44)42-18-8-14-34-11-4-6-16-41(34)42)36-26-21-32(22-27-36)31-19-24-35(25-20-31)40-17-7-13-33-10-3-5-15-39(33)40;1-3-12-28(13-4-1)34-25-35(29-14-5-2-6-15-29)27-36(26-34)40-42-39(33-23-22-30-16-7-8-18-32(30)24-33)43-41(44-40)38-21-11-19-31-17-9-10-20-37(31)38;1-2-9-28(10-3-1)30-17-19-31(20-18-30)32-21-24-34(25-22-32)39-42-40(36-26-23-29-11-4-5-13-35(29)27-36)44-41(43-39)38-16-8-14-33-12-6-7-15-37(33)38;1-2-8-24(9-3-1)27-14-18-28(19-15-27)33-36-34(31-20-16-25-10-4-6-12-29(25)22-31)38-35(37-33)32-21-17-26-11-5-7-13-30(26)23-32/h1-29H;2*1-27H;1-23H |
| InChIKey | VUQJJEQMYVHXKR-UHFFFAOYSA-N |
| XLogP | 41.54 |
| TPSA | 154.68 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 12 |
| Rotatable Bonds | 19 |
| Heavy Atoms | 174 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2220.71 |
| LogP ≤ 5 | 41.54 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 12 |