methyl 4-[(1-oxo-4-phenyl-1H-2-benzopyran-3-carbonyl)amino]benzoate
Chemical Structure Depiction of
methyl 4-[(1-oxo-4-phenyl-1H-2-benzopyran-3-carbonyl)amino]benzoate
methyl 4-[(1-oxo-4-phenyl-1H-2-benzopyran-3-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | K953-0259 |
| Compound Name: | methyl 4-[(1-oxo-4-phenyl-1H-2-benzopyran-3-carbonyl)amino]benzoate |
| Molecular Weight: | 399.4 |
| Molecular Formula: | C24 H17 N O5 |
| Smiles: | COC(c1ccc(cc1)NC(C1=C(c2ccccc2)c2ccccc2C(=O)O1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2625 |
| logD: | 4.2618 |
| logSw: | -4.4861 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.233 |
| InChI Key: | YYNIWTIRPLSOOU-UHFFFAOYSA-N |