4-(2-methylpropyl)-N-[2-(piperazin-1-yl)-5-(pyrrolidine-1-carbonyl)phenyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-(2-methylpropyl)-N-[2-(piperazin-1-yl)-5-(pyrrolidine-1-carbonyl)phenyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
4-(2-methylpropyl)-N-[2-(piperazin-1-yl)-5-(pyrrolidine-1-carbonyl)phenyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-0390 |
| Compound Name: | 4-(2-methylpropyl)-N-[2-(piperazin-1-yl)-5-(pyrrolidine-1-carbonyl)phenyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 584.66 |
| Molecular Formula: | C25 H34 N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | CC(C)Cc1ccc(cc1)S(Nc1cc(ccc1N1CCNCC1)C(N1CCCC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.646 |
| logD: | 3.646 |
| logSw: | -4.0668 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.317 |
| InChI Key: | YIFLOAGDOQJJNY-UHFFFAOYSA-N |