3,4-dimethyl-N-[2-(piperazin-1-yl)-5-(pyrrolidine-1-carbonyl)phenyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3,4-dimethyl-N-[2-(piperazin-1-yl)-5-(pyrrolidine-1-carbonyl)phenyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
3,4-dimethyl-N-[2-(piperazin-1-yl)-5-(pyrrolidine-1-carbonyl)phenyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-0336 |
| Compound Name: | 3,4-dimethyl-N-[2-(piperazin-1-yl)-5-(pyrrolidine-1-carbonyl)phenyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 556.6 |
| Molecular Formula: | C23 H30 N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | Cc1ccc(cc1C)S(Nc1cc(ccc1N1CCNCC1)C(N1CCCC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8943 |
| logD: | 2.8943 |
| logSw: | -3.5021 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.317 |
| InChI Key: | YORJYKRJGTVKHM-UHFFFAOYSA-N |