3-(2-chloro-5-nitrophenyl)-3-(3,4,5-trimethoxybenzamido)propanoic acid
Chemical Structure Depiction of
3-(2-chloro-5-nitrophenyl)-3-(3,4,5-trimethoxybenzamido)propanoic acid
3-(2-chloro-5-nitrophenyl)-3-(3,4,5-trimethoxybenzamido)propanoic acid
Compound characteristics
| Compound ID: | 8015-6808 |
| Compound Name: | 3-(2-chloro-5-nitrophenyl)-3-(3,4,5-trimethoxybenzamido)propanoic acid |
| Molecular Weight: | 438.82 |
| Molecular Formula: | C19 H19 Cl N2 O8 |
| Smiles: | COc1cc(cc(c1OC)OC)C(NC(CC(O)=O)c1cc(ccc1[Cl])[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6371 |
| logD: | -0.0006 |
| logSw: | -3.4003 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 109.025 |
| InChI Key: | IHUXIFPXLCDRHE-AWEZNQCLSA-N |