2-{[(3,5-dimethoxyphenyl)methyl]sulfanyl}-1-(3-ethoxypropyl)-5-(3-methylpiperidine-1-sulfonyl)-1H-benzimidazole
Chemical Structure Depiction of
2-{[(3,5-dimethoxyphenyl)methyl]sulfanyl}-1-(3-ethoxypropyl)-5-(3-methylpiperidine-1-sulfonyl)-1H-benzimidazole
2-{[(3,5-dimethoxyphenyl)methyl]sulfanyl}-1-(3-ethoxypropyl)-5-(3-methylpiperidine-1-sulfonyl)-1H-benzimidazole
Compound characteristics
| Compound ID: | V009-5872 |
| Compound Name: | 2-{[(3,5-dimethoxyphenyl)methyl]sulfanyl}-1-(3-ethoxypropyl)-5-(3-methylpiperidine-1-sulfonyl)-1H-benzimidazole |
| Molecular Weight: | 547.74 |
| Molecular Formula: | C27 H37 N3 O5 S2 |
| Salt: | not_available |
| Smiles: | CCOCCCn1c2ccc(cc2nc1SCc1cc(cc(c1)OC)OC)S(N1CCCC(C)C1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4052 |
| logD: | 5.4039 |
| logSw: | -5.3474 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 65.437 |
| InChI Key: | TZZMGPJSOQIIRU-FQEVSTJZSA-N |