methyl 3-[(8-methyl-4-oxo-4H-thieno[3,2-c][1]benzopyran-2-carbonyl)amino]thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-[(8-methyl-4-oxo-4H-thieno[3,2-c][1]benzopyran-2-carbonyl)amino]thiophene-2-carboxylate
methyl 3-[(8-methyl-4-oxo-4H-thieno[3,2-c][1]benzopyran-2-carbonyl)amino]thiophene-2-carboxylate
Compound characteristics
| Compound ID: | C593-1326 |
| Compound Name: | methyl 3-[(8-methyl-4-oxo-4H-thieno[3,2-c][1]benzopyran-2-carbonyl)amino]thiophene-2-carboxylate |
| Molecular Weight: | 399.44 |
| Molecular Formula: | C19 H13 N O5 S2 |
| Smiles: | Cc1ccc2c(c1)c1c(cc(C(Nc3ccsc3C(=O)OC)=O)s1)C(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 4.3579 |
| logD: | 4.2376 |
| logSw: | -4.4349 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.493 |
| InChI Key: | LHMLPPSAKTTXPN-UHFFFAOYSA-N |