6-ethoxy-2-[(2-nitro-2-phenylethenyl)sulfanyl]-1,3-benzothiazole
Chemical Structure Depiction of
6-ethoxy-2-[(2-nitro-2-phenylethenyl)sulfanyl]-1,3-benzothiazole
6-ethoxy-2-[(2-nitro-2-phenylethenyl)sulfanyl]-1,3-benzothiazole
Compound characteristics
| Compound ID: | 8010-2742 |
| Compound Name: | 6-ethoxy-2-[(2-nitro-2-phenylethenyl)sulfanyl]-1,3-benzothiazole |
| Molecular Weight: | 358.44 |
| Molecular Formula: | C17 H14 N2 O3 S2 |
| Smiles: | CCOc1ccc2c(c1)sc(n2)S/C=C(\c1ccccc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.4288 |
| logD: | 5.4288 |
| logSw: | -5.4656 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.43 |
| InChI Key: | PQUNHMQLFOUYFP-UHFFFAOYSA-N |