4-[3-(1-acetylpiperidin-4-yl)pyrrolidine-1-sulfonyl]benzonitrile
Chemical Structure Depiction of
4-[3-(1-acetylpiperidin-4-yl)pyrrolidine-1-sulfonyl]benzonitrile
4-[3-(1-acetylpiperidin-4-yl)pyrrolidine-1-sulfonyl]benzonitrile
Compound characteristics
| Compound ID: | S632-4201 |
| Compound Name: | 4-[3-(1-acetylpiperidin-4-yl)pyrrolidine-1-sulfonyl]benzonitrile |
| Molecular Weight: | 361.46 |
| Molecular Formula: | C18 H23 N3 O3 S |
| Smiles: | CC(N1CCC(CC1)C1CCN(C1)S(c1ccc(C#N)cc1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7936 |
| logD: | 1.7936 |
| logSw: | -2.5055 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.421 |
| InChI Key: | XHFDGLJODVJEDL-QGZVFWFLSA-N |