4-[(2,3-dihydro-1,4-benzodioxine-6-carbonyl)amino]benzoic acid
Chemical Structure Depiction of
4-[(2,3-dihydro-1,4-benzodioxine-6-carbonyl)amino]benzoic acid
4-[(2,3-dihydro-1,4-benzodioxine-6-carbonyl)amino]benzoic acid
Compound characteristics
| Compound ID: | Y200-6130 |
| Compound Name: | 4-[(2,3-dihydro-1,4-benzodioxine-6-carbonyl)amino]benzoic acid |
| Molecular Weight: | 299.28 |
| Molecular Formula: | C16 H13 N O5 |
| Smiles: | C1COc2cc(ccc2O1)C(Nc1ccc(cc1)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.931 |
| logD: | -0.4642 |
| logSw: | -2.4987 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.561 |
| InChI Key: | KTOQLMSEMTTYOY-UHFFFAOYSA-N |