3-(3-{[4-(4-chlorobenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,2,4-oxadiazol-5-yl)-N-cyclohexyl-N-methylpropanamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-(3-{[4-(4-chlorobenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,2,4-oxadiazol-5-yl)-N-cyclohexyl-N-methylpropanamide--hydrogen chloride (1/1)
3-(3-{[4-(4-chlorobenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,2,4-oxadiazol-5-yl)-N-cyclohexyl-N-methylpropanamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | E823-0035 |
| Compound Name: | 3-(3-{[4-(4-chlorobenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,2,4-oxadiazol-5-yl)-N-cyclohexyl-N-methylpropanamide--hydrogen chloride (1/1) |
| Molecular Weight: | 546.52 |
| Molecular Formula: | C23 H32 Cl N5 O4 S |
| Salt: | HCl |
| Smiles: | CN(C1CCCCC1)C(CCc1nc(CN2CCN(CC2)S(c2ccc(cc2)[Cl])(=O)=O)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0062 |
| logD: | 3.006 |
| logSw: | -3.5161 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 82.77 |
| InChI Key: | ITXPNUIQTMFEBQ-UHFFFAOYSA-N |