methyl 2-[(1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carbonyl)amino]benzoate
Chemical Structure Depiction of
methyl 2-[(1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carbonyl)amino]benzoate
methyl 2-[(1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | D136-0089 |
| Compound Name: | methyl 2-[(1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carbonyl)amino]benzoate |
| Molecular Weight: | 401.42 |
| Molecular Formula: | C24 H19 N O5 |
| Smiles: | COC(c1ccccc1NC(c1ccc2C(=O)OC(Cc2c1)c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4985 |
| logD: | 3.6625 |
| logSw: | -4.4222 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.358 |
| InChI Key: | AGHWQOZRCHIIRX-NRFANRHFSA-N |