1-[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]-3-methylbutan-1-one
Chemical Structure Depiction of
1-[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]-3-methylbutan-1-one
1-[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]-3-methylbutan-1-one
Compound characteristics
| Compound ID: | 8014-0456 |
| Compound Name: | 1-[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]-3-methylbutan-1-one |
| Molecular Weight: | 325.79 |
| Molecular Formula: | C15 H20 Cl N3 O3 |
| Smiles: | CC(C)CC(N1CCN(CC1)c1ccc(cc1[Cl])[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4167 |
| logD: | 3.4167 |
| logSw: | -3.7571 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.972 |
| InChI Key: | UWZNZESRCZDAID-UHFFFAOYSA-N |