6,7-dimethoxy-2-[(3-nitrophenoxy)methyl]-4H-3,1-benzoxazin-4-one
Chemical Structure Depiction of
6,7-dimethoxy-2-[(3-nitrophenoxy)methyl]-4H-3,1-benzoxazin-4-one
6,7-dimethoxy-2-[(3-nitrophenoxy)methyl]-4H-3,1-benzoxazin-4-one
Compound characteristics
| Compound ID: | 4334-1456 |
| Compound Name: | 6,7-dimethoxy-2-[(3-nitrophenoxy)methyl]-4H-3,1-benzoxazin-4-one |
| Molecular Weight: | 358.31 |
| Molecular Formula: | C17 H14 N2 O7 |
| Smiles: | COc1cc2C(=O)OC(COc3cccc(c3)[N+]([O-])=O)=Nc2cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.7138 |
| logD: | 2.7138 |
| logSw: | -3.3617 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 86.473 |
| InChI Key: | OENZHUMHSKFYSU-UHFFFAOYSA-N |