1-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]-2,2-dimethylpropan-1-one
Chemical Structure Depiction of
1-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]-2,2-dimethylpropan-1-one
1-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]-2,2-dimethylpropan-1-one
Compound characteristics
| Compound ID: | 8014-0476 |
| Compound Name: | 1-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]-2,2-dimethylpropan-1-one |
| Molecular Weight: | 325.79 |
| Molecular Formula: | C15 H20 Cl N3 O3 |
| Smiles: | CC(C)(C)C(N1CCN(CC1)c1ccc(cc1[N+]([O-])=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.3059 |
| logD: | 3.3059 |
| logSw: | -3.6661 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.198 |
| InChI Key: | TXTNIFWEXPBIGK-UHFFFAOYSA-N |