N-(2-methoxy-5-nitrophenyl)-4-oxo-4H-thieno[3,2-c][1]benzopyran-2-carboxamide
Chemical Structure Depiction of
N-(2-methoxy-5-nitrophenyl)-4-oxo-4H-thieno[3,2-c][1]benzopyran-2-carboxamide
N-(2-methoxy-5-nitrophenyl)-4-oxo-4H-thieno[3,2-c][1]benzopyran-2-carboxamide
Compound characteristics
| Compound ID: | C186-0069 |
| Compound Name: | N-(2-methoxy-5-nitrophenyl)-4-oxo-4H-thieno[3,2-c][1]benzopyran-2-carboxamide |
| Molecular Weight: | 396.38 |
| Molecular Formula: | C19 H12 N2 O6 S |
| Smiles: | COc1ccc(cc1NC(c1cc2C(=O)Oc3ccccc3c2s1)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.1062 |
| logD: | 4.0213 |
| logSw: | -4.4803 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.312 |
| InChI Key: | HFQSUOJLSRJVAZ-UHFFFAOYSA-N |