methyl 4-({[1-(3-ethoxypropyl)-5-(3-methylpiperidine-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}methyl)-3-methoxybenzoate
Chemical Structure Depiction of
methyl 4-({[1-(3-ethoxypropyl)-5-(3-methylpiperidine-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}methyl)-3-methoxybenzoate
methyl 4-({[1-(3-ethoxypropyl)-5-(3-methylpiperidine-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}methyl)-3-methoxybenzoate
Compound characteristics
| Compound ID: | V001-2785 |
| Compound Name: | methyl 4-({[1-(3-ethoxypropyl)-5-(3-methylpiperidine-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}methyl)-3-methoxybenzoate |
| Molecular Weight: | 575.75 |
| Molecular Formula: | C28 H37 N3 O6 S2 |
| Salt: | not_available |
| Smiles: | CCOCCCn1c2ccc(cc2nc1SCc1ccc(cc1OC)C(=O)OC)S(N1CCCC(C)C1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5585 |
| logD: | 5.5575 |
| logSw: | -5.3512 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 79.153 |
| InChI Key: | KXLVUCCJQMPZOW-FQEVSTJZSA-N |