methyl 2-[(2-oxo-2H-1-benzopyran-3-carbonyl)amino]-4-(4-propylphenyl)thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-[(2-oxo-2H-1-benzopyran-3-carbonyl)amino]-4-(4-propylphenyl)thiophene-3-carboxylate
methyl 2-[(2-oxo-2H-1-benzopyran-3-carbonyl)amino]-4-(4-propylphenyl)thiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y200-2341 |
| Compound Name: | methyl 2-[(2-oxo-2H-1-benzopyran-3-carbonyl)amino]-4-(4-propylphenyl)thiophene-3-carboxylate |
| Molecular Weight: | 447.51 |
| Molecular Formula: | C25 H21 N O5 S |
| Smiles: | CCCc1ccc(cc1)c1csc(c1C(=O)OC)NC(C1=Cc2ccccc2OC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5465 |
| logD: | 4.2022 |
| logSw: | -5.5771 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.948 |
| InChI Key: | XSYRVSBLSOFFAV-UHFFFAOYSA-N |