methyl (2-{[2-(4-ethylphenoxy)ethyl]sulfanyl}-1H-benzimidazol-1-yl)acetate
Chemical Structure Depiction of
methyl (2-{[2-(4-ethylphenoxy)ethyl]sulfanyl}-1H-benzimidazol-1-yl)acetate
methyl (2-{[2-(4-ethylphenoxy)ethyl]sulfanyl}-1H-benzimidazol-1-yl)acetate
Compound characteristics
| Compound ID: | D347-0584 |
| Compound Name: | methyl (2-{[2-(4-ethylphenoxy)ethyl]sulfanyl}-1H-benzimidazol-1-yl)acetate |
| Molecular Weight: | 370.47 |
| Molecular Formula: | C20 H22 N2 O3 S |
| Smiles: | CCc1ccc(cc1)OCCSc1nc2ccccc2n1CC(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.6752 |
| logD: | 4.6712 |
| logSw: | -4.3561 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 38.746 |
| InChI Key: | CQQUWBCELKPOBJ-UHFFFAOYSA-N |