methyl 4-chloro-2-{[3-(4-chlorophenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-6-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-chloro-2-{[3-(4-chlorophenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-6-carbonyl]amino}benzoate
methyl 4-chloro-2-{[3-(4-chlorophenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-6-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | D429-0248 |
| Compound Name: | methyl 4-chloro-2-{[3-(4-chlorophenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-6-carbonyl]amino}benzoate |
| Molecular Weight: | 470.31 |
| Molecular Formula: | C24 H17 Cl2 N O5 |
| Smiles: | COC(c1ccc(cc1NC(c1ccc2C(=O)OC(Cc2c1)c1ccc(cc1)[Cl])=O)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5837 |
| logD: | 2.9363 |
| logSw: | -6.0716 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.358 |
| InChI Key: | JGFFRURRJLDCHG-OAQYLSRUSA-N |