methyl 5-acetyl-4-methyl-2-[(4-oxo-4H-1-benzopyran-2-carbonyl)amino]thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 5-acetyl-4-methyl-2-[(4-oxo-4H-1-benzopyran-2-carbonyl)amino]thiophene-3-carboxylate
methyl 5-acetyl-4-methyl-2-[(4-oxo-4H-1-benzopyran-2-carbonyl)amino]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | D103-2289 |
| Compound Name: | methyl 5-acetyl-4-methyl-2-[(4-oxo-4H-1-benzopyran-2-carbonyl)amino]thiophene-3-carboxylate |
| Molecular Weight: | 385.39 |
| Molecular Formula: | C19 H15 N O6 S |
| Smiles: | [H]N(C(C1=CC(c2ccccc2O1)=O)=O)c1c(C(=O)OC)c(C)c(C(C)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.6917 |
| logD: | -1.8265 |
| logSw: | -3.5335 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.943 |
| InChI Key: | BRLUYUMVHHGENH-UHFFFAOYSA-N |