3-(6-chloro-2-oxo-2H-1,4-benzoxazin-3-yl)propanoic acid
Chemical Structure Depiction of
3-(6-chloro-2-oxo-2H-1,4-benzoxazin-3-yl)propanoic acid
3-(6-chloro-2-oxo-2H-1,4-benzoxazin-3-yl)propanoic acid
Compound characteristics
| Compound ID: | 8015-0108 |
| Compound Name: | 3-(6-chloro-2-oxo-2H-1,4-benzoxazin-3-yl)propanoic acid |
| Molecular Weight: | 253.64 |
| Molecular Formula: | C11 H8 Cl N O4 |
| Smiles: | C(CC(O)=O)C1C(=O)Oc2ccc(cc2N=1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 1.2956 |
| logD: | -1.3637 |
| logSw: | -2.3653 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.556 |
| InChI Key: | WCRDDKVERFEJQC-UHFFFAOYSA-N |