4-[2-(4-propyl-4H-1,2,4-triazol-3-yl)piperidine-1-sulfonyl]benzonitrile
Chemical Structure Depiction of
4-[2-(4-propyl-4H-1,2,4-triazol-3-yl)piperidine-1-sulfonyl]benzonitrile
4-[2-(4-propyl-4H-1,2,4-triazol-3-yl)piperidine-1-sulfonyl]benzonitrile
Compound characteristics
| Compound ID: | P935-1505 |
| Compound Name: | 4-[2-(4-propyl-4H-1,2,4-triazol-3-yl)piperidine-1-sulfonyl]benzonitrile |
| Molecular Weight: | 359.45 |
| Molecular Formula: | C17 H21 N5 O2 S |
| Smiles: | CCCn1cnnc1C1CCCCN1S(c1ccc(C#N)cc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9016 |
| logD: | 1.9014 |
| logSw: | -2.3438 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.811 |
| InChI Key: | MBDDGZOMNSYBNH-INIZCTEOSA-N |