C36H21NOS — CID 170278114
9-(7-dibenzofuran-3-yldibenzothiophen-2-yl)carbazole (PubChem CID 170278114) has the molecular formula C36H21NOS and a molecular weight of 515.64 g/mol. Its IUPAC name is 9-(7-dibenzofuran-3-yldibenzothiophen-2-yl)carbazole.
| Compound Name | 9-(7-dibenzofuran-3-yldibenzothiophen-2-yl)carbazole |
|---|---|
| PubChem CID | 170278114 |
| Molecular Formula | C36H21NOS |
| Molecular Weight | 515.64 g/mol |
| Exact Mass | 515.13 |
| IUPAC Name | 9-(7-dibenzofuran-3-yldibenzothiophen-2-yl)carbazole |
| SMILES | c1ccc2c(c1)oc1cc(-c3ccc4c(c3)sc3ccc(-n5c6ccccc6c6ccccc65)cc34)ccc12 |
| InChI | InChI=1S/C36H21NOS/c1-4-10-31-25(7-1)26-8-2-5-11-32(26)37(31)24-15-18-35-30(21-24)29-17-14-23(20-36(29)39-35)22-13-16-28-27-9-3-6-12-33(27)38-34(28)19-22/h1-21H |
| InChIKey | AZHKQBVBMOLKJQ-UHFFFAOYSA-N |
| XLogP | 10.72 |
| TPSA | 18.07 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 39 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 515.64 |
| LogP ≤ 5 | 10.72 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |