N-(2-methoxy-5-nitrophenyl)-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Chemical Structure Depiction of
N-(2-methoxy-5-nitrophenyl)-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide
N-(2-methoxy-5-nitrophenyl)-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Compound characteristics
| Compound ID: | C849-0748 |
| Compound Name: | N-(2-methoxy-5-nitrophenyl)-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide |
| Molecular Weight: | 398.46 |
| Molecular Formula: | C19 H14 N2 O4 S2 |
| Smiles: | COc1ccc(cc1NC(c1cc2CSc3ccccc3c2s1)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.6976 |
| logD: | 4.6806 |
| logSw: | -4.542 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.311 |
| InChI Key: | SJIBALLWGUCNKK-UHFFFAOYSA-N |