6,7-dimethoxy-2-(4-nitrophenyl)-4H-3,1-benzoxazin-4-one
Chemical Structure Depiction of
6,7-dimethoxy-2-(4-nitrophenyl)-4H-3,1-benzoxazin-4-one
6,7-dimethoxy-2-(4-nitrophenyl)-4H-3,1-benzoxazin-4-one
Compound characteristics
| Compound ID: | 8006-8362 |
| Compound Name: | 6,7-dimethoxy-2-(4-nitrophenyl)-4H-3,1-benzoxazin-4-one |
| Molecular Weight: | 328.28 |
| Molecular Formula: | C16 H12 N2 O6 |
| Smiles: | COc1cc2C(=O)OC(c3ccc(cc3)[N+]([O-])=O)=Nc2cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.6091 |
| logD: | 2.6091 |
| logSw: | -3.3541 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.828 |
| InChI Key: | SHEMIUCVLMATCO-UHFFFAOYSA-N |