diethyl 5-[(6-methoxy-2-oxo-2H-1-benzopyran-3-carbonyl)amino]-3-methylthiophene-2,4-dicarboxylate
Chemical Structure Depiction of
diethyl 5-[(6-methoxy-2-oxo-2H-1-benzopyran-3-carbonyl)amino]-3-methylthiophene-2,4-dicarboxylate
diethyl 5-[(6-methoxy-2-oxo-2H-1-benzopyran-3-carbonyl)amino]-3-methylthiophene-2,4-dicarboxylate
Compound characteristics
| Compound ID: | 8006-5308 |
| Compound Name: | diethyl 5-[(6-methoxy-2-oxo-2H-1-benzopyran-3-carbonyl)amino]-3-methylthiophene-2,4-dicarboxylate |
| Molecular Weight: | 459.47 |
| Molecular Formula: | C22 H21 N O8 S |
| Smiles: | CCOC(c1c(C)c(C(=O)OCC)sc1NC(C1=Cc2cc(ccc2OC1=O)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.469 |
| logD: | -1.295 |
| logSw: | -4.0178 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.097 |
| InChI Key: | MSBIFFAKRBARPM-UHFFFAOYSA-N |