C203H131N21 — CID 161116554
7-[9-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole;7-[9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole;7-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole;9-phenyl-7-[9-[3-(2-phenyl-6-pyridin-2-yl-4-pyridinyl)phenyl]carbazol-4-yl]pyrido[2,3-b]indole (PubChem CID 161116554) has the molecular formula C203H131N21 and a molecular weight of 2864.43 g/mol. Its IUPAC name is 7-[9-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole;7-[9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole;7-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole;9-phenyl-7-[9-[3-(2-phenyl-6-pyridin-2-yl-4-pyridinyl)phenyl]carbazol-4-yl]pyrido[2,3-b]indole.
| Compound Name | 7-[9-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole;7-[9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole;7-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole;9-phenyl-7-[9-[3-(2-phenyl-6-pyridin-2-yl-4-pyridinyl)phenyl]carbazol-4-yl]pyrido[2,3-b]indole |
|---|---|
| PubChem CID | 161116554 |
| Molecular Formula | C203H131N21 |
| Molecular Weight | 2864.43 g/mol |
| Exact Mass | 2862.09 |
| IUPAC Name | 7-[9-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole;7-[9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole;7-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole;9-phenyl-7-[9-[3-(2-phenyl-6-pyridin-2-yl-4-pyridinyl)phenyl]carbazol-4-yl]pyrido[2,3-b]indole |
| SMILES | c1ccc(-c2cc(-c3ccc(-n4c5ccccc5c5c(-c6ccc7c8cccnc8n(-c8ccccc8)c7c6)cccc54)cc3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3cccc(-n4c5ccccc5c5c(-c6ccc7c8cccnc8n(-c8ccccc8)c7c6)cccc54)c3)cc(-c3ccccn3)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5c(-c6ccc7c8cccnc8n(-c8ccccc8)c7c6)cccc54)cc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5c(-c6ccc7c8cccnc8n(-c8ccccc8)c7c6)cccc54)cc3)n2)cc1 |
| InChI | InChI=1S/3C51H33N5.C50H32N6/c1-4-14-34(15-5-1)44-33-45(54-50(53-44)36-16-6-2-7-17-36)35-25-28-39(29-26-35)55-46-23-11-10-20-43(46)49-40(21-12-24-47(49)55)37-27-30-41-42-22-13-31-52-51(42)56(48(41)32-37)38-18-8-3-9-19-38;1-4-14-34(15-5-1)44-33-45(35-16-6-2-7-17-35)54-50(53-44)36-25-28-39(29-26-36)55-46-23-11-10-20-43(46)49-40(21-12-24-47(49)55)37-27-30-41-42-22-13-31-52-51(42)56(48(41)32-37)38-18-8-3-9-19-38;1-3-14-34(15-4-1)45-31-37(32-46(54-45)44-23-9-10-28-52-44)35-16-11-19-39(30-35)55-47-24-8-7-20-43(47)50-40(21-12-25-48(50)55)36-26-27-41-42-22-13-29-53-51(42)56(49(41)33-36)38-17-5-2-6-18-38;1-4-14-33(15-5-1)47-52-48(34-16-6-2-7-17-34)54-49(53-47)35-25-28-38(29-26-35)55-43-23-11-10-20-42(43)46-39(21-12-24-44(46)55)36-27-30-40-41-22-13-31-51-50(41)56(45(40)32-36)37-18-8-3-9-19-37/h3*1-33H;1-32H |
| InChIKey | UKJWWTLIVZNUPO-UHFFFAOYSA-N |
| XLogP | 50.33 |
| TPSA | 207.01 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 21 |
| Rotatable Bonds | 24 |
| Heavy Atoms | 224 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2864.43 |
| LogP ≤ 5 | 50.33 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 21 |