3-[(2-methoxy-5-nitrophenyl)methyl]-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-[(2-methoxy-5-nitrophenyl)methyl]-1,3-benzoxazol-2(3H)-one
3-[(2-methoxy-5-nitrophenyl)methyl]-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | 8019-3851 |
| Compound Name: | 3-[(2-methoxy-5-nitrophenyl)methyl]-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 300.27 |
| Molecular Formula: | C15 H12 N2 O5 |
| Smiles: | COc1ccc(cc1CN1C(=O)Oc2ccccc12)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.9445 |
| logD: | 2.9445 |
| logSw: | -3.5093 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.079 |
| InChI Key: | UMBNQQNZZGWRBF-UHFFFAOYSA-N |