C137H88N14O5 — CID 157231716
10-(4-carbazol-9-ylphenyl)furo[2,3-a]carbazole;10-(4,5-diphenyl-1,2,4-triazol-3-yl)furo[2,3-a]carbazole;(E)-3-furo[2,3-a]carbazol-10-yl-1-phenylbut-2-ene-1,4-diimine;10-(4-isoquinolin-4-ylphenyl)furo[2,3-a]carbazole;10-(6-phenylpyridazin-3-yl)furo[2,3-a]carbazole (PubChem CID 157231716) has the molecular formula C137H88N14O5 and a molecular weight of 2010.30 g/mol. Its IUPAC name is 10-(4-carbazol-9-ylphenyl)furo[2,3-a]carbazole;10-(4,5-diphenyl-1,2,4-triazol-3-yl)furo[2,3-a]carbazole;(E)-3-furo[2,3-a]carbazol-10-yl-1-phenylbut-2-ene-1,4-diimine;10-(4-isoquinolin-4-ylphenyl)furo[2,3-a]carbazole;10-(6-phenylpyridazin-3-yl)furo[2,3-a]carbazole.
| Compound Name | 10-(4-carbazol-9-ylphenyl)furo[2,3-a]carbazole;10-(4,5-diphenyl-1,2,4-triazol-3-yl)furo[2,3-a]carbazole;(E)-3-furo[2,3-a]carbazol-10-yl-1-phenylbut-2-ene-1,4-diimine;10-(4-isoquinolin-4-ylphenyl)furo[2,3-a]carbazole;10-(6-phenylpyridazin-3-yl)furo[2,3-a]carbazole |
|---|---|
| PubChem CID | 157231716 |
| Molecular Formula | C137H88N14O5 |
| Molecular Weight | 2010.30 g/mol |
| Exact Mass | 2008.71 |
| IUPAC Name | 10-(4-carbazol-9-ylphenyl)furo[2,3-a]carbazole;10-(4,5-diphenyl-1,2,4-triazol-3-yl)furo[2,3-a]carbazole;(E)-3-furo[2,3-a]carbazol-10-yl-1-phenylbut-2-ene-1,4-diimine;10-(4-isoquinolin-4-ylphenyl)furo[2,3-a]carbazole;10-(6-phenylpyridazin-3-yl)furo[2,3-a]carbazole |
| SMILES | [H]/N=C(/C=C(\C=N\[H])n1c2ccccc2c2ccc3ccoc3c21)c1ccccc1.c1ccc(-c2ccc(-n3c4ccccc4c4ccc5ccoc5c43)nn2)cc1.c1ccc(-c2nnc(-n3c4ccccc4c4ccc5ccoc5c43)n2-c2ccccc2)cc1.c1ccc2c(-c3ccc(-n4c5ccccc5c5ccc6ccoc6c54)cc3)cncc2c1.c1ccc2c(c1)c1ccccc1n2-c1ccc(-n2c3ccccc3c3ccc4ccoc4c32)cc1 |
| InChI | InChI=1S/C32H20N2O.C29H18N2O.C28H18N4O.C24H15N3O.C24H17N3O/c1-4-10-28-24(7-1)25-8-2-5-11-29(25)33(28)22-14-16-23(17-15-22)34-30-12-6-3-9-26(30)27-18-13-21-19-20-35-32(21)31(27)34;1-2-6-23-21(5-1)17-30-18-26(23)19-9-12-22(13-10-19)31-27-8-4-3-7-24(27)25-14-11-20-15-16-32-29(20)28(25)31;1-3-9-20(10-4-1)27-29-30-28(31(27)21-11-5-2-6-12-21)32-24-14-8-7-13-22(24)23-16-15-19-17-18-33-26(19)25(23)32;1-2-6-16(7-3-1)20-12-13-22(26-25-20)27-21-9-5-4-8-18(21)19-11-10-17-14-15-28-24(17)23(19)27;25-15-18(14-21(26)16-6-2-1-3-7-16)27-22-9-5-4-8-19(22)20-11-10-17-12-13-28-24(17)23(20)27/h1-20H;1-18H;1-18H;1-15H;1-15,25-26H/b;;;;18-14+,25-15+,26-21- |
| InChIKey | AUEKICDJPAYVSC-BGVSCWNYSA-N |
| XLogP | 35.24 |
| TPSA | 212.36 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 19 |
| Rotatable Bonds | 13 |
| Heavy Atoms | 156 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2010.30 |
| LogP ≤ 5 | 35.24 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 19 |
| Structural Alerts | {'alert_name': 'imine_1', 'substructure': 'N/A'} |
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