propan-2-yl [(1H-benzimidazol-2-yl)sulfanyl]acetate
Chemical Structure Depiction of
propan-2-yl [(1H-benzimidazol-2-yl)sulfanyl]acetate
propan-2-yl [(1H-benzimidazol-2-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | 3578-0898 |
| Compound Name: | propan-2-yl [(1H-benzimidazol-2-yl)sulfanyl]acetate |
| Molecular Weight: | 250.32 |
| Molecular Formula: | C12 H14 N2 O2 S |
| Smiles: | CC(C)OC(CSc1nc2ccccc2[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3424 |
| logD: | 2.2902 |
| logSw: | -2.5766 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.089 |
| InChI Key: | HIFJWDBUUBMUAV-UHFFFAOYSA-N |