C153H105N15 — CID 158484941
N,N-diphenyl-2-[4-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]phenyl]aniline;N,N-diphenyl-3-[4-[4-phenyl-6-(9-phenylcarbazol-2-yl)-1,3,5-triazin-2-yl]phenyl]aniline;N,N-diphenyl-4-[4-[4-phenyl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]phenyl]aniline (PubChem CID 158484941) has the molecular formula C153H105N15 and a molecular weight of 2153.63 g/mol. Its IUPAC name is N,N-diphenyl-2-[4-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]phenyl]aniline;N,N-diphenyl-3-[4-[4-phenyl-6-(9-phenylcarbazol-2-yl)-1,3,5-triazin-2-yl]phenyl]aniline;N,N-diphenyl-4-[4-[4-phenyl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]phenyl]aniline.
| Compound Name | N,N-diphenyl-2-[4-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]phenyl]aniline;N,N-diphenyl-3-[4-[4-phenyl-6-(9-phenylcarbazol-2-yl)-1,3,5-triazin-2-yl]phenyl]aniline;N,N-diphenyl-4-[4-[4-phenyl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]phenyl]aniline |
|---|---|
| PubChem CID | 158484941 |
| Molecular Formula | C153H105N15 |
| Molecular Weight | 2153.63 g/mol |
| Exact Mass | 2151.87 |
| IUPAC Name | N,N-diphenyl-2-[4-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]phenyl]aniline;N,N-diphenyl-3-[4-[4-phenyl-6-(9-phenylcarbazol-2-yl)-1,3,5-triazin-2-yl]phenyl]aniline;N,N-diphenyl-4-[4-[4-phenyl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]phenyl]aniline |
| SMILES | c1ccc(-c2nc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)nc(-c3cccc4c5ccccc5n(-c5ccccc5)c34)n2)cc1.c1ccc(-c2nc(-c3ccc(-c4cccc(N(c5ccccc5)c5ccccc5)c4)cc3)nc(-c3ccc4c5ccccc5n(-c5ccccc5)c4c3)n2)cc1.c1ccc(-c2nc(-c3ccc(-c4ccccc4N(c4ccccc4)c4ccccc4)cc3)nc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)n2)cc1 |
| InChI | InChI=1S/3C51H35N5/c1-5-17-37(18-6-1)49-52-50(54-51(53-49)39-33-34-48-45(35-39)44-26-14-16-28-47(44)56(48)42-23-11-4-12-24-42)38-31-29-36(30-32-38)43-25-13-15-27-46(43)55(40-19-7-2-8-20-40)41-21-9-3-10-22-41;1-5-16-37(17-6-1)49-52-50(54-51(53-49)40-32-33-46-45-26-13-14-27-47(45)56(48(46)35-40)43-23-11-4-12-24-43)38-30-28-36(29-31-38)39-18-15-25-44(34-39)55(41-19-7-2-8-20-41)42-21-9-3-10-22-42;1-5-16-38(17-6-1)49-52-50(54-51(53-49)46-26-15-25-45-44-24-13-14-27-47(44)56(48(45)46)42-22-11-4-12-23-42)39-30-28-36(29-31-39)37-32-34-43(35-33-37)55(40-18-7-2-8-19-40)41-20-9-3-10-21-41/h3*1-35H |
| InChIKey | HHZCPNCREMDPAG-UHFFFAOYSA-N |
| XLogP | 39.32 |
| TPSA | 140.52 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 15 |
| Rotatable Bonds | 24 |
| Heavy Atoms | 168 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2153.63 |
| LogP ≤ 5 | 39.32 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 15 |