6-ethoxy-2-{[3-(4-nitrophenyl)prop-2-en-1-yl]sulfanyl}-1,3-benzothiazole
Chemical Structure Depiction of
6-ethoxy-2-{[3-(4-nitrophenyl)prop-2-en-1-yl]sulfanyl}-1,3-benzothiazole
6-ethoxy-2-{[3-(4-nitrophenyl)prop-2-en-1-yl]sulfanyl}-1,3-benzothiazole
Compound characteristics
| Compound ID: | 8008-5030 |
| Compound Name: | 6-ethoxy-2-{[3-(4-nitrophenyl)prop-2-en-1-yl]sulfanyl}-1,3-benzothiazole |
| Molecular Weight: | 372.46 |
| Molecular Formula: | C18 H16 N2 O3 S2 |
| Smiles: | CCOc1ccc2c(c1)sc(n2)SC/C=C/c1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.9279 |
| logD: | 5.9279 |
| logSw: | -5.6019 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.554 |
| InChI Key: | BELVFXDSTPSFBX-UHFFFAOYSA-N |