3-(3-chlorophenyl)-3-(4,5-dimethoxy-2-nitrobenzamido)propanoic acid
Chemical Structure Depiction of
3-(3-chlorophenyl)-3-(4,5-dimethoxy-2-nitrobenzamido)propanoic acid
3-(3-chlorophenyl)-3-(4,5-dimethoxy-2-nitrobenzamido)propanoic acid
Compound characteristics
| Compound ID: | 8015-5819 |
| Compound Name: | 3-(3-chlorophenyl)-3-(4,5-dimethoxy-2-nitrobenzamido)propanoic acid |
| Molecular Weight: | 408.79 |
| Molecular Formula: | C18 H17 Cl N2 O7 |
| Smiles: | COc1cc(C(NC(CC(O)=O)c2cccc(c2)[Cl])=O)c(cc1OC)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6449 |
| logD: | 0.0071 |
| logSw: | -3.3409 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.007 |
| InChI Key: | XTQXFFORNJPKAK-ZDUSSCGKSA-N |