N-{5-[4-(4-chlorophenyl)piperazine-1-carbonyl]-2-(piperazin-1-yl)phenyl}methanesulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-{5-[4-(4-chlorophenyl)piperazine-1-carbonyl]-2-(piperazin-1-yl)phenyl}methanesulfonamide--trifluoroacetic acid (1/1)
N-{5-[4-(4-chlorophenyl)piperazine-1-carbonyl]-2-(piperazin-1-yl)phenyl}methanesulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-0135 |
| Compound Name: | N-{5-[4-(4-chlorophenyl)piperazine-1-carbonyl]-2-(piperazin-1-yl)phenyl}methanesulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 592.04 |
| Molecular Formula: | C22 H28 Cl N5 O3 S |
| Salt: | CF3COOH |
| Smiles: | CS(Nc1cc(ccc1N1CCNCC1)C(N1CCN(CC1)c1ccc(cc1)[Cl])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9203 |
| logD: | 1.9203 |
| logSw: | -3.1148 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.429 |
| InChI Key: | JEBVSFQHKYLWQD-UHFFFAOYSA-N |