2-{[(4-chlorophenyl)methyl]sulfanyl}cyclohexyl 3-(piperidin-1-yl)propanoate--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-{[(4-chlorophenyl)methyl]sulfanyl}cyclohexyl 3-(piperidin-1-yl)propanoate--hydrogen chloride (1/1)
2-{[(4-chlorophenyl)methyl]sulfanyl}cyclohexyl 3-(piperidin-1-yl)propanoate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8005-9793 |
| Compound Name: | 2-{[(4-chlorophenyl)methyl]sulfanyl}cyclohexyl 3-(piperidin-1-yl)propanoate--hydrogen chloride (1/1) |
| Molecular Weight: | 432.45 |
| Molecular Formula: | C21 H30 Cl N O2 S |
| Salt: | HCl |
| Smiles: | C1CCN(CC1)CCC(=O)OC1CCCCC1SCc1ccc(cc1)[Cl] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.99 |
| logD: | 3.563 |
| logSw: | -5.0109 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 23.3813 |
| InChI Key: | VAVXGZXHFVMMQV-UHFFFAOYSA-N |