N-benzyl-N-methyl-3-{3-[(4-{4-[(piperidin-1-yl)methyl]benzoyl}piperazin-1-yl)methyl]-1,2,4-oxadiazol-5-yl}propanamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-benzyl-N-methyl-3-{3-[(4-{4-[(piperidin-1-yl)methyl]benzoyl}piperazin-1-yl)methyl]-1,2,4-oxadiazol-5-yl}propanamide--hydrogen chloride (1/1)
N-benzyl-N-methyl-3-{3-[(4-{4-[(piperidin-1-yl)methyl]benzoyl}piperazin-1-yl)methyl]-1,2,4-oxadiazol-5-yl}propanamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | E823-0257 |
| Compound Name: | N-benzyl-N-methyl-3-{3-[(4-{4-[(piperidin-1-yl)methyl]benzoyl}piperazin-1-yl)methyl]-1,2,4-oxadiazol-5-yl}propanamide--hydrogen chloride (1/1) |
| Molecular Weight: | 581.16 |
| Molecular Formula: | C31 H40 N6 O3 |
| Salt: | HCl |
| Smiles: | CN(Cc1ccccc1)C(CCc1nc(CN2CCN(CC2)C(c2ccc(CN3CCCCC3)cc2)=O)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7734 |
| logD: | 1.3224 |
| logSw: | -2.8836 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.388 |
| InChI Key: | ATQSFHHEPHITNA-UHFFFAOYSA-N |