ethyl 2-({[4-(methylsulfanyl)phenyl]methyl}sulfanyl)-1-[(pyridin-2-yl)methyl]-1H-benzimidazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-({[4-(methylsulfanyl)phenyl]methyl}sulfanyl)-1-[(pyridin-2-yl)methyl]-1H-benzimidazole-5-carboxylate
ethyl 2-({[4-(methylsulfanyl)phenyl]methyl}sulfanyl)-1-[(pyridin-2-yl)methyl]-1H-benzimidazole-5-carboxylate
Compound characteristics
| Compound ID: | V012-3659 |
| Compound Name: | ethyl 2-({[4-(methylsulfanyl)phenyl]methyl}sulfanyl)-1-[(pyridin-2-yl)methyl]-1H-benzimidazole-5-carboxylate |
| Molecular Weight: | 449.59 |
| Molecular Formula: | C24 H23 N3 O2 S2 |
| Salt: | not_available |
| Smiles: | CCOC(c1ccc2c(c1)nc(n2Cc1ccccn1)SCc1ccc(cc1)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6754 |
| logD: | 5.506 |
| logSw: | -5.4873 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 40.774 |
| InChI Key: | XRRIZNNTRBEQJF-UHFFFAOYSA-N |