ethyl 2-{[(4-methoxy-3-methylphenyl)methyl]sulfanyl}-1-[(pyridin-2-yl)methyl]-1H-benzimidazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-{[(4-methoxy-3-methylphenyl)methyl]sulfanyl}-1-[(pyridin-2-yl)methyl]-1H-benzimidazole-5-carboxylate
ethyl 2-{[(4-methoxy-3-methylphenyl)methyl]sulfanyl}-1-[(pyridin-2-yl)methyl]-1H-benzimidazole-5-carboxylate
Compound characteristics
| Compound ID: | V015-0840 |
| Compound Name: | ethyl 2-{[(4-methoxy-3-methylphenyl)methyl]sulfanyl}-1-[(pyridin-2-yl)methyl]-1H-benzimidazole-5-carboxylate |
| Molecular Weight: | 447.56 |
| Molecular Formula: | C25 H25 N3 O3 S |
| Salt: | not_available |
| Smiles: | CCOC(c1ccc2c(c1)nc(n2Cc1ccccn1)SCc1ccc(c(C)c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6399 |
| logD: | 5.4706 |
| logSw: | -5.5125 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.405 |
| InChI Key: | DPGPAUDREFYWGH-UHFFFAOYSA-N |