dimethyl 3-methyl-5-[(1-oxo-1H-2-benzopyran-3-carbonyl)amino]thiophene-2,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 3-methyl-5-[(1-oxo-1H-2-benzopyran-3-carbonyl)amino]thiophene-2,4-dicarboxylate
dimethyl 3-methyl-5-[(1-oxo-1H-2-benzopyran-3-carbonyl)amino]thiophene-2,4-dicarboxylate
Compound characteristics
| Compound ID: | 6049-1513 |
| Compound Name: | dimethyl 3-methyl-5-[(1-oxo-1H-2-benzopyran-3-carbonyl)amino]thiophene-2,4-dicarboxylate |
| Molecular Weight: | 401.39 |
| Molecular Formula: | C19 H15 N O7 S |
| Smiles: | Cc1c(C(=O)OC)c(NC(C2=Cc3ccccc3C(=O)O2)=O)sc1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.8069 |
| logD: | -0.9812 |
| logSw: | -3.6732 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.879 |
| InChI Key: | IWCAQKMZGBIYBC-UHFFFAOYSA-N |