2-({[1-(3-ethoxypropyl)-5-(3-methylpiperidine-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}methyl)phenyl acetate
Chemical Structure Depiction of
2-({[1-(3-ethoxypropyl)-5-(3-methylpiperidine-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}methyl)phenyl acetate
2-({[1-(3-ethoxypropyl)-5-(3-methylpiperidine-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}methyl)phenyl acetate
Compound characteristics
| Compound ID: | V005-1517 |
| Compound Name: | 2-({[1-(3-ethoxypropyl)-5-(3-methylpiperidine-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}methyl)phenyl acetate |
| Molecular Weight: | 545.72 |
| Molecular Formula: | C27 H35 N3 O5 S2 |
| Salt: | not_available |
| Smiles: | CCOCCCn1c2ccc(cc2nc1SCc1ccccc1OC(C)=O)S(N1CCCC(C)C1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0805 |
| logD: | 5.0794 |
| logSw: | -4.9052 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 71.187 |
| InChI Key: | BPDDWMNUQSXXER-FQEVSTJZSA-N |