2-(4-methoxy-3-nitrophenyl)-4H-3,1-benzoxazin-4-one
Chemical Structure Depiction of
2-(4-methoxy-3-nitrophenyl)-4H-3,1-benzoxazin-4-one
2-(4-methoxy-3-nitrophenyl)-4H-3,1-benzoxazin-4-one
Compound characteristics
| Compound ID: | 2237-0023 |
| Compound Name: | 2-(4-methoxy-3-nitrophenyl)-4H-3,1-benzoxazin-4-one |
| Molecular Weight: | 298.25 |
| Molecular Formula: | C15 H10 N2 O5 |
| Smiles: | COc1ccc(cc1[N+]([O-])=O)C1=Nc2ccccc2C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 2.1591 |
| logD: | 2.1591 |
| logSw: | -3.0248 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.896 |
| InChI Key: | ALXDQDNKDCVDHJ-UHFFFAOYSA-N |