2-{[(3-chlorophenyl)methyl]sulfanyl}-1-(3-ethoxypropyl)-5-(3-methylpiperidine-1-sulfonyl)-1H-benzimidazole
Chemical Structure Depiction of
2-{[(3-chlorophenyl)methyl]sulfanyl}-1-(3-ethoxypropyl)-5-(3-methylpiperidine-1-sulfonyl)-1H-benzimidazole
2-{[(3-chlorophenyl)methyl]sulfanyl}-1-(3-ethoxypropyl)-5-(3-methylpiperidine-1-sulfonyl)-1H-benzimidazole
Compound characteristics
| Compound ID: | V003-3966 |
| Compound Name: | 2-{[(3-chlorophenyl)methyl]sulfanyl}-1-(3-ethoxypropyl)-5-(3-methylpiperidine-1-sulfonyl)-1H-benzimidazole |
| Molecular Weight: | 522.13 |
| Molecular Formula: | C25 H32 Cl N3 O3 S2 |
| Salt: | not_available |
| Smiles: | CCOCCCn1c2ccc(cc2nc1SCc1cccc(c1)[Cl])S(N1CCCC(C)C1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.9359 |
| logD: | 5.9345 |
| logSw: | -6.0594 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 50.349 |
| InChI Key: | HTSQHISQRAJVNQ-IBGZPJMESA-N |