C104H64N8 — CID 163468032
10-carbazol-9-yl-7-[3-(3-naphthalen-1-ylphenyl)quinoxalin-2-yl]benzo[c]carbazole;10-carbazol-9-yl-7-[3-(3-naphthalen-2-ylphenyl)quinoxalin-2-yl]benzo[c]carbazole (PubChem CID 163468032) has the molecular formula C104H64N8 and a molecular weight of 1425.71 g/mol. Its IUPAC name is 10-carbazol-9-yl-7-[3-(3-naphthalen-1-ylphenyl)quinoxalin-2-yl]benzo[c]carbazole;10-carbazol-9-yl-7-[3-(3-naphthalen-2-ylphenyl)quinoxalin-2-yl]benzo[c]carbazole.
| Compound Name | 10-carbazol-9-yl-7-[3-(3-naphthalen-1-ylphenyl)quinoxalin-2-yl]benzo[c]carbazole;10-carbazol-9-yl-7-[3-(3-naphthalen-2-ylphenyl)quinoxalin-2-yl]benzo[c]carbazole |
|---|---|
| PubChem CID | 163468032 |
| Molecular Formula | C104H64N8 |
| Molecular Weight | 1425.71 g/mol |
| Exact Mass | 1424.53 |
| IUPAC Name | 10-carbazol-9-yl-7-[3-(3-naphthalen-1-ylphenyl)quinoxalin-2-yl]benzo[c]carbazole;10-carbazol-9-yl-7-[3-(3-naphthalen-2-ylphenyl)quinoxalin-2-yl]benzo[c]carbazole |
| SMILES | c1cc(-c2ccc3ccccc3c2)cc(-c2nc3ccccc3nc2-n2c3ccc(-n4c5ccccc5c5ccccc54)cc3c3c4ccccc4ccc32)c1.c1cc(-c2nc3ccccc3nc2-n2c3ccc(-n4c5ccccc5c5ccccc54)cc3c3c4ccccc4ccc32)cc(-c2cccc3ccccc23)c1 |
| InChI | InChI=1S/2C52H32N4/c1-3-18-38-33(13-1)15-12-22-39(38)35-16-11-17-36(31-35)51-52(54-45-24-8-7-23-44(45)53-51)56-48-30-28-37(32-43(48)50-40-19-4-2-14-34(40)27-29-49(50)56)55-46-25-9-5-20-41(46)42-21-6-10-26-47(42)55;1-2-14-35-30-37(25-24-33(35)12-1)36-15-11-16-38(31-36)51-52(54-45-21-8-7-20-44(45)53-51)56-48-29-27-39(32-43(48)50-40-17-4-3-13-34(40)26-28-49(50)56)55-46-22-9-5-18-41(46)42-19-6-10-23-47(42)55/h2*1-32H |
| InChIKey | BUGLGQJAYNDACD-UHFFFAOYSA-N |
| XLogP | 26.93 |
| TPSA | 71.28 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Heavy Atoms | 112 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1425.71 |
| LogP ≤ 5 | 26.93 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 8 |