ethyl 2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-1-(3-ethoxypropyl)-1H-benzimidazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-1-(3-ethoxypropyl)-1H-benzimidazole-5-carboxylate
ethyl 2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-1-(3-ethoxypropyl)-1H-benzimidazole-5-carboxylate
Compound characteristics
| Compound ID: | V008-1923 |
| Compound Name: | ethyl 2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-1-(3-ethoxypropyl)-1H-benzimidazole-5-carboxylate |
| Molecular Weight: | 450.96 |
| Molecular Formula: | C22 H24 Cl F N2 O3 S |
| Salt: | not_available |
| Smiles: | CCOCCCn1c2ccc(cc2nc1SCc1c(cccc1[Cl])F)C(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 6.0771 |
| logD: | 6.0767 |
| logSw: | -6.1534 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 39.458 |
| InChI Key: | FDQSZTUWWKRIFY-UHFFFAOYSA-N |