1-ethyl-N-[(pyridin-4-yl)methyl]-3-(thiomorpholine-4-sulfonyl)-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
1-ethyl-N-[(pyridin-4-yl)methyl]-3-(thiomorpholine-4-sulfonyl)-1H-pyrazole-4-carboxamide
1-ethyl-N-[(pyridin-4-yl)methyl]-3-(thiomorpholine-4-sulfonyl)-1H-pyrazole-4-carboxamide
Compound characteristics
Compound ID: | M461-0627 |
Compound Name: | 1-ethyl-N-[(pyridin-4-yl)methyl]-3-(thiomorpholine-4-sulfonyl)-1H-pyrazole-4-carboxamide |
Molecular Weight: | 395.5 |
Molecular Formula: | C16 H21 N5 O3 S2 |
Smiles: | CCn1cc(C(NCc2ccncc2)=O)c(n1)S(N1CCSCC1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 0.2578 |
logD: | 0.2543 |
logSw: | -1.9701 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 80.614 |
InChI Key: | IXPMSOLMECOQFJ-UHFFFAOYSA-N |