C195H121N17O10 — CID 161343523
4-(1,8-dipyridin-4-ylcarbazol-9-yl)-2-(2-phenylphenyl)isoindole-1,3-dione;4-(2,7-dipyridin-4-ylcarbazol-9-yl)-2-(2-phenylphenyl)isoindole-1,3-dione;2-(2-phenylphenyl)-4-(1-pyridin-4-ylcarbazol-9-yl)isoindole-1,3-dione;2-(2-phenylphenyl)-4-(2-pyridin-4-ylcarbazol-9-yl)isoindole-1,3-dione;2-(2-phenylphenyl)-4-(3-pyridin-4-ylcarbazol-9-yl)isoindole-1,3-dione (PubChem CID 161343523) has the molecular formula C195H121N17O10 and a molecular weight of 2862.22 g/mol. Its IUPAC name is 4-(1,8-dipyridin-4-ylcarbazol-9-yl)-2-(2-phenylphenyl)isoindole-1,3-dione;4-(2,7-dipyridin-4-ylcarbazol-9-yl)-2-(2-phenylphenyl)isoindole-1,3-dione;2-(2-phenylphenyl)-4-(1-pyridin-4-ylcarbazol-9-yl)isoindole-1,3-dione;2-(2-phenylphenyl)-4-(2-pyridin-4-ylcarbazol-9-yl)isoindole-1,3-dione;2-(2-phenylphenyl)-4-(3-pyridin-4-ylcarbazol-9-yl)isoindole-1,3-dione.
| Compound Name | 4-(1,8-dipyridin-4-ylcarbazol-9-yl)-2-(2-phenylphenyl)isoindole-1,3-dione;4-(2,7-dipyridin-4-ylcarbazol-9-yl)-2-(2-phenylphenyl)isoindole-1,3-dione;2-(2-phenylphenyl)-4-(1-pyridin-4-ylcarbazol-9-yl)isoindole-1,3-dione;2-(2-phenylphenyl)-4-(2-pyridin-4-ylcarbazol-9-yl)isoindole-1,3-dione;2-(2-phenylphenyl)-4-(3-pyridin-4-ylcarbazol-9-yl)isoindole-1,3-dione |
|---|---|
| PubChem CID | 161343523 |
| Molecular Formula | C195H121N17O10 |
| Molecular Weight | 2862.22 g/mol |
| Exact Mass | 2859.95 |
| IUPAC Name | 4-(1,8-dipyridin-4-ylcarbazol-9-yl)-2-(2-phenylphenyl)isoindole-1,3-dione;4-(2,7-dipyridin-4-ylcarbazol-9-yl)-2-(2-phenylphenyl)isoindole-1,3-dione;2-(2-phenylphenyl)-4-(1-pyridin-4-ylcarbazol-9-yl)isoindole-1,3-dione;2-(2-phenylphenyl)-4-(2-pyridin-4-ylcarbazol-9-yl)isoindole-1,3-dione;2-(2-phenylphenyl)-4-(3-pyridin-4-ylcarbazol-9-yl)isoindole-1,3-dione |
| SMILES | O=C1c2cccc(-n3c4c(-c5ccncc5)cccc4c4cccc(-c5ccncc5)c43)c2C(=O)N1c1ccccc1-c1ccccc1.O=C1c2cccc(-n3c4cc(-c5ccncc5)ccc4c4ccc(-c5ccncc5)cc43)c2C(=O)N1c1ccccc1-c1ccccc1.O=C1c2cccc(-n3c4ccccc4c4cc(-c5ccncc5)ccc43)c2C(=O)N1c1ccccc1-c1ccccc1.O=C1c2cccc(-n3c4ccccc4c4ccc(-c5ccncc5)cc43)c2C(=O)N1c1ccccc1-c1ccccc1.O=C1c2cccc(-n3c4ccccc4c4cccc(-c5ccncc5)c43)c2C(=O)N1c1ccccc1-c1ccccc1 |
| InChI | InChI=1S/2C42H26N4O2.3C37H23N3O2/c47-41-35-16-8-18-37(38(35)42(48)46(41)36-17-5-4-11-30(36)27-9-2-1-3-10-27)45-39-31(28-19-23-43-24-20-28)12-6-14-33(39)34-15-7-13-32(40(34)45)29-21-25-44-26-22-29;47-41-35-10-6-12-37(40(35)42(48)46(41)36-11-5-4-9-32(36)29-7-2-1-3-8-29)45-38-25-30(27-17-21-43-22-18-27)13-15-33(38)34-16-14-31(26-39(34)45)28-19-23-44-24-20-28;41-36-30-16-9-19-33(34(30)37(42)40(36)31-17-6-4-12-26(31)24-10-2-1-3-11-24)39-32-18-7-5-13-28(32)29-15-8-14-27(35(29)39)25-20-22-38-23-21-25;41-36-30-13-8-16-33(35(30)37(42)40(36)31-14-6-4-11-27(31)25-9-2-1-3-10-25)39-32-15-7-5-12-28(32)29-18-17-26(23-34(29)39)24-19-21-38-22-20-24;41-36-29-13-8-16-34(35(29)37(42)40(36)31-14-6-4-11-27(31)25-9-2-1-3-10-25)39-32-15-7-5-12-28(32)30-23-26(17-18-33(30)39)24-19-21-38-22-20-24/h2*1-26H;3*1-23H |
| InChIKey | VMZMCUWGVQPSDQ-UHFFFAOYSA-N |
| XLogP | 43.69 |
| TPSA | 301.78 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 22 |
| Rotatable Bonds | 22 |
| Heavy Atoms | 222 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2862.22 |
| LogP ≤ 5 | 43.69 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 22 |
| Structural Alerts | {'alert_name': 'phthalimide', 'substructure': 'N/A'} |
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