ethyl 2-{[(2,3-difluoro-4-methylphenyl)methyl]sulfanyl}-1-(3-ethoxypropyl)-1H-benzimidazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-{[(2,3-difluoro-4-methylphenyl)methyl]sulfanyl}-1-(3-ethoxypropyl)-1H-benzimidazole-5-carboxylate
ethyl 2-{[(2,3-difluoro-4-methylphenyl)methyl]sulfanyl}-1-(3-ethoxypropyl)-1H-benzimidazole-5-carboxylate
Compound characteristics
| Compound ID: | V017-5929 |
| Compound Name: | ethyl 2-{[(2,3-difluoro-4-methylphenyl)methyl]sulfanyl}-1-(3-ethoxypropyl)-1H-benzimidazole-5-carboxylate |
| Molecular Weight: | 448.53 |
| Molecular Formula: | C23 H26 F2 N2 O3 S |
| Salt: | not_available |
| Smiles: | CCOCCCn1c2ccc(cc2nc1SCc1ccc(C)c(c1F)F)C(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 6.4414 |
| logD: | 6.441 |
| logSw: | -5.5836 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 39.458 |
| InChI Key: | HQKCHBIDYSBBTB-UHFFFAOYSA-N |