4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxylic acid
Chemical Structure Depiction of
4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxylic acid
4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxylic acid
Compound characteristics
| Compound ID: | 8020-0638 |
| Compound Name: | 4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxylic acid |
| Molecular Weight: | 207.18 |
| Molecular Formula: | C10 H9 N O4 |
| Smiles: | CN1C(COc2ccc(cc12)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8218 |
| logD: | -0.9955 |
| logSw: | -1.531 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.514 |
| InChI Key: | YAECFAFQQDKRKF-UHFFFAOYSA-N |