C244H166N10 — CID 161377239
2,4-diphenyl-6-[3-phenyl-5-(2,3,4,5-tetraphenylphenyl)phenyl]-1,3,5-triazine;4-naphthalen-1-yl-6-[2-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]-2-phenylpyrimidine;4-naphthalen-2-yl-6-[2-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]-2-phenylpyrimidine;2-phenyl-4-(3-phenylphenyl)-6-[3-phenyl-5-(2,3,4,5-tetraphenylphenyl)phenyl]-1,3,5-triazine (PubChem CID 161377239) has the molecular formula C244H166N10 and a molecular weight of 3238.08 g/mol. Its IUPAC name is 2,4-diphenyl-6-[3-phenyl-5-(2,3,4,5-tetraphenylphenyl)phenyl]-1,3,5-triazine;4-naphthalen-1-yl-6-[2-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]-2-phenylpyrimidine;4-naphthalen-2-yl-6-[2-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]-2-phenylpyrimidine;2-phenyl-4-(3-phenylphenyl)-6-[3-phenyl-5-(2,3,4,5-tetraphenylphenyl)phenyl]-1,3,5-triazine.
| Compound Name | 2,4-diphenyl-6-[3-phenyl-5-(2,3,4,5-tetraphenylphenyl)phenyl]-1,3,5-triazine;4-naphthalen-1-yl-6-[2-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]-2-phenylpyrimidine;4-naphthalen-2-yl-6-[2-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]-2-phenylpyrimidine;2-phenyl-4-(3-phenylphenyl)-6-[3-phenyl-5-(2,3,4,5-tetraphenylphenyl)phenyl]-1,3,5-triazine |
|---|---|
| PubChem CID | 161377239 |
| Molecular Formula | C244H166N10 |
| Molecular Weight | 3238.08 g/mol |
| Exact Mass | 3235.33 |
| IUPAC Name | 2,4-diphenyl-6-[3-phenyl-5-(2,3,4,5-tetraphenylphenyl)phenyl]-1,3,5-triazine;4-naphthalen-1-yl-6-[2-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]-2-phenylpyrimidine;4-naphthalen-2-yl-6-[2-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]-2-phenylpyrimidine;2-phenyl-4-(3-phenylphenyl)-6-[3-phenyl-5-(2,3,4,5-tetraphenylphenyl)phenyl]-1,3,5-triazine |
| SMILES | c1ccc(-c2cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc(-c3cc(-c4ccccc4)c(-c4ccccc4)c(-c4ccccc4)c3-c3ccccc3)c2)cc1.c1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4cc(-c5ccccc5)cc(-c5cc(-c6ccccc6)c(-c6ccccc6)c(-c6ccccc6)c5-c5ccccc5)c4)n3)c2)cc1.c1ccc(-c2nc(-c3ccc4ccccc4c3)cc(-c3ccccc3-c3c(-c4ccccc4)c(-c4ccccc4)c(-c4ccccc4)c(-c4ccccc4)c3-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3-c3c(-c4ccccc4)c(-c4ccccc4)c(-c4ccccc4)c(-c4ccccc4)c3-c3ccccc3)cc(-c3cccc4ccccc34)n2)cc1 |
| InChI | InChI=1S/C63H43N3.2C62H42N2.C57H39N3/c1-8-23-44(24-9-1)51-37-22-38-52(39-51)62-64-61(50-35-20-7-21-36-50)65-63(66-62)55-41-53(45-25-10-2-11-26-45)40-54(42-55)57-43-56(46-27-12-3-13-28-46)58(47-29-14-4-15-30-47)60(49-33-18-6-19-34-49)59(57)48-31-16-5-17-32-48;1-7-25-44(26-8-1)56-57(45-27-9-2-10-28-45)59(47-31-13-4-14-32-47)61(60(48-33-15-5-16-34-48)58(56)46-29-11-3-12-30-46)53-40-22-21-39-52(53)55-42-54(63-62(64-55)49-35-17-6-18-36-49)51-41-23-37-43-24-19-20-38-50(43)51;1-7-24-44(25-8-1)56-57(45-26-9-2-10-27-45)59(47-30-13-4-14-31-47)61(60(48-32-15-5-16-33-48)58(56)46-28-11-3-12-29-46)53-38-22-21-37-52(53)55-42-54(63-62(64-55)49-34-17-6-18-35-49)51-40-39-43-23-19-20-36-50(43)41-51;1-8-22-40(23-9-1)47-36-48(38-49(37-47)57-59-55(45-32-18-6-19-33-45)58-56(60-57)46-34-20-7-21-35-46)51-39-50(41-24-10-2-11-25-41)52(42-26-12-3-13-27-42)54(44-30-16-5-17-31-44)53(51)43-28-14-4-15-29-43/h1-43H;2*1-42H;1-39H |
| InChIKey | VRFTYYSFYHCTKQ-UHFFFAOYSA-N |
| XLogP | 64.68 |
| TPSA | 128.90 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 10 |
| Rotatable Bonds | 37 |
| Heavy Atoms | 254 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3238.08 |
| LogP ≤ 5 | 64.68 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 10 |