ethyl 4,5-dimethyl-2-{[3-(4-methylphenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-6-carbonyl]amino}thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 4,5-dimethyl-2-{[3-(4-methylphenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-6-carbonyl]amino}thiophene-3-carboxylate
ethyl 4,5-dimethyl-2-{[3-(4-methylphenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-6-carbonyl]amino}thiophene-3-carboxylate
Compound characteristics
| Compound ID: | D429-0206 |
| Compound Name: | ethyl 4,5-dimethyl-2-{[3-(4-methylphenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-6-carbonyl]amino}thiophene-3-carboxylate |
| Molecular Weight: | 463.55 |
| Molecular Formula: | C26 H25 N O5 S |
| Smiles: | CCOC(c1c(C)c(C)sc1NC(c1ccc2C(=O)OC(Cc2c1)c1ccc(C)cc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6558 |
| logD: | 1.3085 |
| logSw: | -5.6099 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.43 |
| InChI Key: | DJSVERWZAJHQCF-OAQYLSRUSA-N |