N-benzyl-3-(3-{[4-(5-bromothiophene-2-sulfonyl)piperazin-1-yl]methyl}-1,2,4-oxadiazol-5-yl)-N-methylpropanamide
Chemical Structure Depiction of
N-benzyl-3-(3-{[4-(5-bromothiophene-2-sulfonyl)piperazin-1-yl]methyl}-1,2,4-oxadiazol-5-yl)-N-methylpropanamide
N-benzyl-3-(3-{[4-(5-bromothiophene-2-sulfonyl)piperazin-1-yl]methyl}-1,2,4-oxadiazol-5-yl)-N-methylpropanamide
Compound characteristics
| Compound ID: | E823-0027 |
| Compound Name: | N-benzyl-3-(3-{[4-(5-bromothiophene-2-sulfonyl)piperazin-1-yl]methyl}-1,2,4-oxadiazol-5-yl)-N-methylpropanamide |
| Molecular Weight: | 604.97 |
| Molecular Formula: | C22 H26 Br N5 O4 S2 |
| Salt: | HCl |
| Smiles: | CN(Cc1ccccc1)C(CCc1nc(CN2CCN(CC2)S(c2ccc(s2)[Br])(=O)=O)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1247 |
| logD: | 3.1244 |
| logSw: | -3.2966 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 84.736 |
| InChI Key: | MBPFWRKWEIGSLM-UHFFFAOYSA-N |