propan-2-yl 5-methyl-2-[(2-oxo-2H-1-benzopyran-3-carbonyl)amino]-4-phenylthiophene-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 5-methyl-2-[(2-oxo-2H-1-benzopyran-3-carbonyl)amino]-4-phenylthiophene-3-carboxylate
propan-2-yl 5-methyl-2-[(2-oxo-2H-1-benzopyran-3-carbonyl)amino]-4-phenylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y200-6386 |
| Compound Name: | propan-2-yl 5-methyl-2-[(2-oxo-2H-1-benzopyran-3-carbonyl)amino]-4-phenylthiophene-3-carboxylate |
| Molecular Weight: | 447.51 |
| Molecular Formula: | C25 H21 N O5 S |
| Smiles: | CC(C)OC(c1c(c2ccccc2)c(C)sc1NC(C1=Cc2ccccc2OC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3165 |
| logD: | 2.9142 |
| logSw: | -5.5337 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.207 |
| InChI Key: | JMTYXXGQZNLMDY-UHFFFAOYSA-N |