6,7-dimethoxy-2-(3-nitrophenyl)-4H-3,1-benzoxazin-4-one
Chemical Structure Depiction of
6,7-dimethoxy-2-(3-nitrophenyl)-4H-3,1-benzoxazin-4-one
6,7-dimethoxy-2-(3-nitrophenyl)-4H-3,1-benzoxazin-4-one
Compound characteristics
| Compound ID: | 3952-0134 |
| Compound Name: | 6,7-dimethoxy-2-(3-nitrophenyl)-4H-3,1-benzoxazin-4-one |
| Molecular Weight: | 328.28 |
| Molecular Formula: | C16 H12 N2 O6 |
| Smiles: | COc1cc2C(=O)OC(c3cccc(c3)[N+]([O-])=O)=Nc2cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.6035 |
| logD: | 2.6035 |
| logSw: | -3.2619 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.828 |
| InChI Key: | HSFDECLWIMVSIE-UHFFFAOYSA-N |