2-{[(3-chloro-2-fluorophenyl)methyl]sulfanyl}-1-cyclopentyl-5-(3-methylpiperidine-1-sulfonyl)-1H-benzimidazole
Chemical Structure Depiction of
2-{[(3-chloro-2-fluorophenyl)methyl]sulfanyl}-1-cyclopentyl-5-(3-methylpiperidine-1-sulfonyl)-1H-benzimidazole
2-{[(3-chloro-2-fluorophenyl)methyl]sulfanyl}-1-cyclopentyl-5-(3-methylpiperidine-1-sulfonyl)-1H-benzimidazole
Compound characteristics
| Compound ID: | V003-4013 |
| Compound Name: | 2-{[(3-chloro-2-fluorophenyl)methyl]sulfanyl}-1-cyclopentyl-5-(3-methylpiperidine-1-sulfonyl)-1H-benzimidazole |
| Molecular Weight: | 522.1 |
| Molecular Formula: | C25 H29 Cl F N3 O2 S2 |
| Salt: | not_available |
| Smiles: | CC1CCCN(C1)S(c1ccc2c(c1)nc(n2C1CCCC1)SCc1cccc(c1F)[Cl])(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.7869 |
| logD: | 6.7868 |
| logSw: | -6.5285 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 43.064 |
| InChI Key: | RZARDNHZKAIRBT-KRWDZBQOSA-N |