ethyl 4-{[4-(4-methylphenyl)-1-oxo-1H-2-benzopyran-3-carbonyl]amino}benzoate
Chemical Structure Depiction of
ethyl 4-{[4-(4-methylphenyl)-1-oxo-1H-2-benzopyran-3-carbonyl]amino}benzoate
ethyl 4-{[4-(4-methylphenyl)-1-oxo-1H-2-benzopyran-3-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | K953-0063 |
| Compound Name: | ethyl 4-{[4-(4-methylphenyl)-1-oxo-1H-2-benzopyran-3-carbonyl]amino}benzoate |
| Molecular Weight: | 427.46 |
| Molecular Formula: | C26 H21 N O5 |
| Smiles: | CCOC(c1ccc(cc1)NC(C1=C(c2ccc(C)cc2)c2ccccc2C(=O)O1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3016 |
| logD: | 5.3009 |
| logSw: | -5.3445 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.813 |
| InChI Key: | SGDVUVDTFADXSF-UHFFFAOYSA-N |