ethyl 2-({[4-chloro-2-(trifluoromethyl)quinolin-6-yl]methyl}sulfanyl)-1-(3-ethoxypropyl)-1H-benzimidazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-({[4-chloro-2-(trifluoromethyl)quinolin-6-yl]methyl}sulfanyl)-1-(3-ethoxypropyl)-1H-benzimidazole-5-carboxylate
ethyl 2-({[4-chloro-2-(trifluoromethyl)quinolin-6-yl]methyl}sulfanyl)-1-(3-ethoxypropyl)-1H-benzimidazole-5-carboxylate
Compound characteristics
| Compound ID: | V002-9816 |
| Compound Name: | ethyl 2-({[4-chloro-2-(trifluoromethyl)quinolin-6-yl]methyl}sulfanyl)-1-(3-ethoxypropyl)-1H-benzimidazole-5-carboxylate |
| Molecular Weight: | 552.01 |
| Molecular Formula: | C26 H25 Cl F3 N3 O3 S |
| Salt: | not_available |
| Smiles: | CCOCCCn1c2ccc(cc2nc1SCc1ccc2c(c1)c(cc(C(F)(F)F)n2)[Cl])C(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 7.3031 |
| logD: | 7.3017 |
| logSw: | -6.5133 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.789 |
| InChI Key: | DEYJBCPFXYJMTO-UHFFFAOYSA-N |