3-(2H-1,3-benzodioxol-5-yl)-3-(2,4-dichlorobenzamido)propanoic acid
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-3-(2,4-dichlorobenzamido)propanoic acid
3-(2H-1,3-benzodioxol-5-yl)-3-(2,4-dichlorobenzamido)propanoic acid
Compound characteristics
| Compound ID: | 8017-0165 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-3-(2,4-dichlorobenzamido)propanoic acid |
| Molecular Weight: | 382.2 |
| Molecular Formula: | C17 H13 Cl2 N O5 |
| Smiles: | C(C(c1ccc2c(c1)OCO2)NC(c1ccc(cc1[Cl])[Cl])=O)C(O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6575 |
| logD: | 1.0198 |
| logSw: | -4.0109 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.781 |
| InChI Key: | KMXJTEFNXLQJLV-ZDUSSCGKSA-N |