2-{[2-(pyrrolidin-1-yl)ethyl]sulfanyl}-1H-benzimidazole
Chemical Structure Depiction of
2-{[2-(pyrrolidin-1-yl)ethyl]sulfanyl}-1H-benzimidazole
2-{[2-(pyrrolidin-1-yl)ethyl]sulfanyl}-1H-benzimidazole
Compound characteristics
| Compound ID: | 3027-0098 |
| Compound Name: | 2-{[2-(pyrrolidin-1-yl)ethyl]sulfanyl}-1H-benzimidazole |
| Molecular Weight: | 247.36 |
| Molecular Formula: | C13 H17 N3 S |
| Smiles: | C1CCN(C1)CCSc1nc2ccccc2[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 2.1781 |
| logD: | -0.275 |
| logSw: | -2.1453 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 22.3285 |
| InChI Key: | ADAKOCFRTDPWLS-UHFFFAOYSA-N |