1-(4-methylpiperidin-1-yl)-3-[3-({4-[4-(2-methylpropyl)benzene-1-sulfonyl]piperazin-1-yl}methyl)-1,2,4-oxadiazol-5-yl]propan-1-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-(4-methylpiperidin-1-yl)-3-[3-({4-[4-(2-methylpropyl)benzene-1-sulfonyl]piperazin-1-yl}methyl)-1,2,4-oxadiazol-5-yl]propan-1-one--hydrogen chloride (1/1)
1-(4-methylpiperidin-1-yl)-3-[3-({4-[4-(2-methylpropyl)benzene-1-sulfonyl]piperazin-1-yl}methyl)-1,2,4-oxadiazol-5-yl]propan-1-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | E823-0060 |
| Compound Name: | 1-(4-methylpiperidin-1-yl)-3-[3-({4-[4-(2-methylpropyl)benzene-1-sulfonyl]piperazin-1-yl}methyl)-1,2,4-oxadiazol-5-yl]propan-1-one--hydrogen chloride (1/1) |
| Molecular Weight: | 554.15 |
| Molecular Formula: | C26 H39 N5 O4 S |
| Salt: | HCl |
| Smiles: | CC(C)Cc1ccc(cc1)S(N1CCN(CC1)Cc1nc(CCC(N2CCC(C)CC2)=O)on1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5542 |
| logD: | 3.5541 |
| logSw: | -3.746 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 84.216 |
| InChI Key: | QBQTYTIPMJQWPC-UHFFFAOYSA-N |