methyl 3-[(2,5-dimethoxyphenyl)carbamoyl]-5-nitrobenzoate
Chemical Structure Depiction of
methyl 3-[(2,5-dimethoxyphenyl)carbamoyl]-5-nitrobenzoate
methyl 3-[(2,5-dimethoxyphenyl)carbamoyl]-5-nitrobenzoate
Compound characteristics
| Compound ID: | 2616-1939 |
| Compound Name: | methyl 3-[(2,5-dimethoxyphenyl)carbamoyl]-5-nitrobenzoate |
| Molecular Weight: | 360.32 |
| Molecular Formula: | C17 H16 N2 O7 |
| Smiles: | COC(c1cc(cc(c1)[N+]([O-])=O)C(Nc1cc(ccc1OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0188 |
| logD: | 2.6251 |
| logSw: | -3.5864 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.361 |
| InChI Key: | OKKQTNSXXUKZQW-UHFFFAOYSA-N |