C60H36N2 — CID 130295046
5-(4-fluoranthen-2-ylphenyl)-2-(7-phenylbenzo[c]carbazol-10-yl)benzo[b]carbazole (PubChem CID 130295046) has the molecular formula C60H36N2 and a molecular weight of 784.96 g/mol. Its IUPAC name is 5-(4-fluoranthen-2-ylphenyl)-2-(7-phenylbenzo[c]carbazol-10-yl)benzo[b]carbazole.
| Compound Name | 5-(4-fluoranthen-2-ylphenyl)-2-(7-phenylbenzo[c]carbazol-10-yl)benzo[b]carbazole |
|---|---|
| PubChem CID | 130295046 |
| Molecular Formula | C60H36N2 |
| Molecular Weight | 784.96 g/mol |
| Exact Mass | 784.29 |
| IUPAC Name | 5-(4-fluoranthen-2-ylphenyl)-2-(7-phenylbenzo[c]carbazol-10-yl)benzo[b]carbazole |
| SMILES | c1ccc(-n2c3ccc(-c4ccc5c(c4)c4cc6ccccc6cc4n5-c4ccc(-c5cc6c7c(cccc7c5)-c5ccccc5-6)cc4)cc3c3c4ccccc4ccc32)cc1 |
| InChI | InChI=1S/C60H36N2/c1-2-15-45(16-3-1)61-56-29-25-42(34-54(56)60-47-17-7-6-11-38(47)23-30-57(60)61)41-24-28-55-51(33-41)52-32-39-12-4-5-13-40(39)36-58(52)62(55)46-26-21-37(22-27-46)44-31-43-14-10-20-50-48-18-8-9-19-49(48)53(35-44)59(43)50/h1-36H |
| InChIKey | LEVTUVIKOKXJSF-UHFFFAOYSA-N |
| XLogP | 16.32 |
| TPSA | 9.86 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 62 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 784.96 |
| LogP ≤ 5 | 16.32 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |