N-(3-chloro-4-methylphenyl)-1-methyl-3-(thiomorpholine-4-sulfonyl)-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-1-methyl-3-(thiomorpholine-4-sulfonyl)-1H-pyrazole-4-carboxamide
N-(3-chloro-4-methylphenyl)-1-methyl-3-(thiomorpholine-4-sulfonyl)-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | M461-1706 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-1-methyl-3-(thiomorpholine-4-sulfonyl)-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 414.93 |
| Molecular Formula: | C16 H19 Cl N4 O3 S2 |
| Smiles: | Cc1ccc(cc1[Cl])NC(c1cn(C)nc1S(N1CCSCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6263 |
| logD: | 2.5661 |
| logSw: | -3.632 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.171 |
| InChI Key: | OCTJBOKDNNYDCS-UHFFFAOYSA-N |