3-(3-{[4-(4-bromobenzoyl)piperazin-1-yl]methyl}-1,2,4-oxadiazol-5-yl)-1-(4-methylpiperidin-1-yl)propan-1-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-(3-{[4-(4-bromobenzoyl)piperazin-1-yl]methyl}-1,2,4-oxadiazol-5-yl)-1-(4-methylpiperidin-1-yl)propan-1-one--hydrogen chloride (1/1)
3-(3-{[4-(4-bromobenzoyl)piperazin-1-yl]methyl}-1,2,4-oxadiazol-5-yl)-1-(4-methylpiperidin-1-yl)propan-1-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | E823-0362 |
| Compound Name: | 3-(3-{[4-(4-bromobenzoyl)piperazin-1-yl]methyl}-1,2,4-oxadiazol-5-yl)-1-(4-methylpiperidin-1-yl)propan-1-one--hydrogen chloride (1/1) |
| Molecular Weight: | 540.89 |
| Molecular Formula: | C23 H30 Br N5 O3 |
| Salt: | HCl |
| Smiles: | CC1CCN(CC1)C(CCc1nc(CN2CCN(CC2)C(c2ccc(cc2)[Br])=O)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4363 |
| logD: | 2.4359 |
| logSw: | -2.5383 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.153 |
| InChI Key: | PAHZMJKKCUZKRH-UHFFFAOYSA-N |