3-(2-{[2-(3,4-dimethylphenoxy)ethyl]sulfanyl}-1H-benzimidazol-1-yl)propanoic acid
Chemical Structure Depiction of
3-(2-{[2-(3,4-dimethylphenoxy)ethyl]sulfanyl}-1H-benzimidazol-1-yl)propanoic acid
3-(2-{[2-(3,4-dimethylphenoxy)ethyl]sulfanyl}-1H-benzimidazol-1-yl)propanoic acid
Compound characteristics
| Compound ID: | 1465-0032 |
| Compound Name: | 3-(2-{[2-(3,4-dimethylphenoxy)ethyl]sulfanyl}-1H-benzimidazol-1-yl)propanoic acid |
| Molecular Weight: | 370.47 |
| Molecular Formula: | C20 H22 N2 O3 S |
| Smiles: | Cc1ccc(cc1C)OCCSc1nc2ccccc2n1CCC(O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0102 |
| logD: | 1.2028 |
| logSw: | -4.0542 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.529 |
| InChI Key: | QWQOJGSHENBCAF-UHFFFAOYSA-N |