methyl 3-({[1-cyclopentyl-5-(3-methylpiperidine-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}methyl)benzoate
Chemical Structure Depiction of
methyl 3-({[1-cyclopentyl-5-(3-methylpiperidine-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}methyl)benzoate
methyl 3-({[1-cyclopentyl-5-(3-methylpiperidine-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}methyl)benzoate
Compound characteristics
| Compound ID: | V009-0643 |
| Compound Name: | methyl 3-({[1-cyclopentyl-5-(3-methylpiperidine-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}methyl)benzoate |
| Molecular Weight: | 527.7 |
| Molecular Formula: | C27 H33 N3 O4 S2 |
| Salt: | not_available |
| Smiles: | CC1CCCN(C1)S(c1ccc2c(c1)nc(n2C1CCCC1)SCc1cccc(c1)C(=O)OC)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7933 |
| logD: | 5.7932 |
| logSw: | -5.4796 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 64.238 |
| InChI Key: | UAZOLMCKDUHSEF-IBGZPJMESA-N |