methyl 3-[(2-methoxy-5-nitrophenyl)methyl]-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxylate
Chemical Structure Depiction of
methyl 3-[(2-methoxy-5-nitrophenyl)methyl]-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxylate
methyl 3-[(2-methoxy-5-nitrophenyl)methyl]-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxylate
Compound characteristics
| Compound ID: | 8020-2869 |
| Compound Name: | methyl 3-[(2-methoxy-5-nitrophenyl)methyl]-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxylate |
| Molecular Weight: | 358.31 |
| Molecular Formula: | C17 H14 N2 O7 |
| Smiles: | COC(c1ccc2c(c1)N(Cc1cc(ccc1OC)[N+]([O-])=O)C(=O)O2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0106 |
| logD: | 3.0106 |
| logSw: | -3.4965 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 85.253 |
| InChI Key: | WVGPSJBYPXZMII-UHFFFAOYSA-N |