3-(3-{[4-(4-tert-butylbenzene-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-tert-butylbenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,2,4-oxadiazol-5-yl)-N-cyclohexyl-N-methylpropanamide--hydrogen chloride (1/1)
3-(3-{[4-(4-tert-butylbenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,2,4-oxadiazol-5-yl)-N-cyclohexyl-N-methylpropanamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | E823-0037 |
| Compound Name: | 3-(3-{[4-(4-tert-butylbenzene-1-sulfonyl)piperazin-1-yl]methyl}-1,2,4-oxadiazol-5-yl)-N-cyclohexyl-N-methylpropanamide--hydrogen chloride (1/1) |
| Molecular Weight: | 568.18 |
| Molecular Formula: | C27 H41 N5 O4 S |
| Salt: | HCl |
| Smiles: | CC(C)(C)c1ccc(cc1)S(N1CCN(CC1)Cc1nc(CCC(N(C)C2CCCCC2)=O)on1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.206 |
| logD: | 4.2058 |
| logSw: | -3.9739 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 82.77 |
| InChI Key: | LAXRTHATDIDMJF-UHFFFAOYSA-N |