3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxylic acid
Chemical Structure Depiction of
3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxylic acid
3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxylic acid
Compound characteristics
| Compound ID: | 8012-5739 |
| Compound Name: | 3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxylic acid |
| Molecular Weight: | 193.16 |
| Molecular Formula: | C9 H7 N O4 |
| Smiles: | C1C(Nc2cc(ccc2O1)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0058 |
| logD: | -1.01 |
| logSw: | -1.9327 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.917 |
| InChI Key: | CIYUDMUBYRVMLP-UHFFFAOYSA-N |