3-[(1-ethyl-1H-benzimidazol-2-yl)sulfanyl]propanoic acid
Chemical Structure Depiction of
3-[(1-ethyl-1H-benzimidazol-2-yl)sulfanyl]propanoic acid
3-[(1-ethyl-1H-benzimidazol-2-yl)sulfanyl]propanoic acid
Compound characteristics
| Compound ID: | 8011-0210 |
| Compound Name: | 3-[(1-ethyl-1H-benzimidazol-2-yl)sulfanyl]propanoic acid |
| Molecular Weight: | 250.32 |
| Molecular Formula: | C12 H14 N2 O2 S |
| Smiles: | CCn1c2ccccc2nc1SCCC(O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3622 |
| logD: | -0.3335 |
| logSw: | -2.4091 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.129 |
| InChI Key: | BTPUORIJGQSIMG-UHFFFAOYSA-N |