3-(2-{[2-(3-methylphenoxy)ethyl]sulfanyl}-1H-benzimidazol-1-yl)propanoic acid
Chemical Structure Depiction of
3-(2-{[2-(3-methylphenoxy)ethyl]sulfanyl}-1H-benzimidazol-1-yl)propanoic acid
3-(2-{[2-(3-methylphenoxy)ethyl]sulfanyl}-1H-benzimidazol-1-yl)propanoic acid
Compound characteristics
| Compound ID: | 1465-0007 |
| Compound Name: | 3-(2-{[2-(3-methylphenoxy)ethyl]sulfanyl}-1H-benzimidazol-1-yl)propanoic acid |
| Molecular Weight: | 356.44 |
| Molecular Formula: | C19 H20 N2 O3 S |
| Smiles: | Cc1cccc(c1)OCCSc1nc2ccccc2n1CCC(O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4651 |
| logD: | 0.6577 |
| logSw: | -3.6562 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.529 |
| InChI Key: | FOCAKYCVXWBREO-UHFFFAOYSA-N |