{2-[(prop-2-en-1-yl)sulfanyl]-1H-benzimidazol-1-yl}acetic acid
Chemical Structure Depiction of
{2-[(prop-2-en-1-yl)sulfanyl]-1H-benzimidazol-1-yl}acetic acid
{2-[(prop-2-en-1-yl)sulfanyl]-1H-benzimidazol-1-yl}acetic acid
Compound characteristics
| Compound ID: | 0614-1273 |
| Compound Name: | {2-[(prop-2-en-1-yl)sulfanyl]-1H-benzimidazol-1-yl}acetic acid |
| Molecular Weight: | 248.3 |
| Molecular Formula: | C12 H12 N2 O2 S |
| Smiles: | C=CCSc1nc2ccccc2n1CC(O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8643 |
| logD: | -1.9448 |
| logSw: | -2.1552 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.404 |
| InChI Key: | KZYPKCRIFNXKTH-UHFFFAOYSA-N |