1-methyl-N-[3-(methylsulfanyl)phenyl]-3-(piperidine-1-sulfonyl)-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
1-methyl-N-[3-(methylsulfanyl)phenyl]-3-(piperidine-1-sulfonyl)-1H-pyrazole-4-carboxamide
1-methyl-N-[3-(methylsulfanyl)phenyl]-3-(piperidine-1-sulfonyl)-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | M461-7872 |
| Compound Name: | 1-methyl-N-[3-(methylsulfanyl)phenyl]-3-(piperidine-1-sulfonyl)-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 394.51 |
| Molecular Formula: | C17 H22 N4 O3 S2 |
| Smiles: | Cn1cc(C(Nc2cccc(c2)SC)=O)c(n1)S(N1CCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1016 |
| logD: | 2.1006 |
| logSw: | -3.0881 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.171 |
| InChI Key: | XFVUODZVQKTBTG-UHFFFAOYSA-N |