4-[(1-oxo-3,4-dihydro-1H-2-benzopyran-3-carbonyl)amino]benzoic acid
Chemical Structure Depiction of
4-[(1-oxo-3,4-dihydro-1H-2-benzopyran-3-carbonyl)amino]benzoic acid
4-[(1-oxo-3,4-dihydro-1H-2-benzopyran-3-carbonyl)amino]benzoic acid
Compound characteristics
| Compound ID: | D731-0164 |
| Compound Name: | 4-[(1-oxo-3,4-dihydro-1H-2-benzopyran-3-carbonyl)amino]benzoic acid |
| Molecular Weight: | 311.29 |
| Molecular Formula: | C17 H13 N O5 |
| Smiles: | C1C(C(Nc2ccc(cc2)C(O)=O)=O)OC(c2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6359 |
| logD: | 0.2407 |
| logSw: | -3.248 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.562 |
| InChI Key: | CNNGSOKXZWNOFG-AWEZNQCLSA-N |