2-[(4-nitrophenyl)sulfanyl]-1,3-benzothiazole
Chemical Structure Depiction of
2-[(4-nitrophenyl)sulfanyl]-1,3-benzothiazole
2-[(4-nitrophenyl)sulfanyl]-1,3-benzothiazole
Compound characteristics
| Compound ID: | 0375-0527 |
| Compound Name: | 2-[(4-nitrophenyl)sulfanyl]-1,3-benzothiazole |
| Molecular Weight: | 288.34 |
| Molecular Formula: | C13 H8 N2 O2 S2 |
| Smiles: | c1ccc2c(c1)nc(Sc1ccc(cc1)[N+]([O-])=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 4.8998 |
| logD: | 4.8998 |
| logSw: | -5.0049 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.43 |
| InChI Key: | CFKYGISPRYOSCQ-UHFFFAOYSA-N |