2-{3-[4-(6,7-dimethoxy-4-oxo-4H-3,1-benzoxazin-2-yl)phenoxy]phenyl}-6,7-dimethoxy-4H-3,1-benzoxazin-4-one
Chemical Structure Depiction of
2-{3-[4-(6,7-dimethoxy-4-oxo-4H-3,1-benzoxazin-2-yl)phenoxy]phenyl}-6,7-dimethoxy-4H-3,1-benzoxazin-4-one
2-{3-[4-(6,7-dimethoxy-4-oxo-4H-3,1-benzoxazin-2-yl)phenoxy]phenyl}-6,7-dimethoxy-4H-3,1-benzoxazin-4-one
Compound characteristics
| Compound ID: | 8008-3555 |
| Compound Name: | 2-{3-[4-(6,7-dimethoxy-4-oxo-4H-3,1-benzoxazin-2-yl)phenoxy]phenyl}-6,7-dimethoxy-4H-3,1-benzoxazin-4-one |
| Molecular Weight: | 580.55 |
| Molecular Formula: | C32 H24 N2 O9 |
| Smiles: | COc1cc2C(=O)OC(c3ccc(cc3)Oc3cccc(c3)C3=Nc4cc(c(cc4C(=O)O3)OC)OC)=Nc2cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.8645 |
| logD: | 4.8645 |
| logSw: | -4.7028 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 97.402 |
| InChI Key: | MQGVLZVKCKCGHL-UHFFFAOYSA-N |