1-ethyl-N-(3-methylphenyl)-3-(thiomorpholine-4-sulfonyl)-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
1-ethyl-N-(3-methylphenyl)-3-(thiomorpholine-4-sulfonyl)-1H-pyrazole-4-carboxamide
1-ethyl-N-(3-methylphenyl)-3-(thiomorpholine-4-sulfonyl)-1H-pyrazole-4-carboxamide
Compound characteristics
Compound ID: | M461-1715 |
Compound Name: | 1-ethyl-N-(3-methylphenyl)-3-(thiomorpholine-4-sulfonyl)-1H-pyrazole-4-carboxamide |
Molecular Weight: | 394.51 |
Molecular Formula: | C17 H22 N4 O3 S2 |
Smiles: | CCn1cc(C(Nc2cccc(C)c2)=O)c(n1)S(N1CCSCC1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.0106 |
logD: | 2.0102 |
logSw: | -2.8033 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 69.864 |
InChI Key: | TXHOLFQWZZPMSZ-UHFFFAOYSA-N |