3-(3-{[4-(4-bromobenzoyl)piperazin-1-yl]methyl}-1,2,4-oxadiazol-5-yl)-1-(pyrrolidin-1-yl)propan-1-one
Chemical Structure Depiction of
3-(3-{[4-(4-bromobenzoyl)piperazin-1-yl]methyl}-1,2,4-oxadiazol-5-yl)-1-(pyrrolidin-1-yl)propan-1-one
3-(3-{[4-(4-bromobenzoyl)piperazin-1-yl]methyl}-1,2,4-oxadiazol-5-yl)-1-(pyrrolidin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | E823-0416 |
| Compound Name: | 3-(3-{[4-(4-bromobenzoyl)piperazin-1-yl]methyl}-1,2,4-oxadiazol-5-yl)-1-(pyrrolidin-1-yl)propan-1-one |
| Molecular Weight: | 512.83 |
| Molecular Formula: | C21 H26 Br N5 O3 |
| Salt: | HCl |
| Smiles: | C1CCN(C1)C(CCc1nc(CN2CCN(CC2)C(c2ccc(cc2)[Br])=O)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.887 |
| logD: | 1.8865 |
| logSw: | -2.3134 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.519 |
| InChI Key: | JMSGIUVQFXTVEE-UHFFFAOYSA-N |