2-[(1,3-benzothiazol-2-yl)sulfanyl]-N-(4-methoxy-2-nitrophenyl)acetamide
Chemical Structure Depiction of
2-[(1,3-benzothiazol-2-yl)sulfanyl]-N-(4-methoxy-2-nitrophenyl)acetamide
2-[(1,3-benzothiazol-2-yl)sulfanyl]-N-(4-methoxy-2-nitrophenyl)acetamide
Compound characteristics
| Compound ID: | 2805-0019 |
| Compound Name: | 2-[(1,3-benzothiazol-2-yl)sulfanyl]-N-(4-methoxy-2-nitrophenyl)acetamide |
| Molecular Weight: | 375.42 |
| Molecular Formula: | C16 H13 N3 O4 S2 |
| Smiles: | COc1ccc(c(c1)[N+]([O-])=O)NC(CSc1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3438 |
| logD: | 4.3199 |
| logSw: | -4.4028 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.124 |
| InChI Key: | NMBXYAWUOCSHGW-UHFFFAOYSA-N |