N-[(3-ethoxyphenyl)methyl]-1-methyl-3-(thiomorpholine-4-sulfonyl)-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
N-[(3-ethoxyphenyl)methyl]-1-methyl-3-(thiomorpholine-4-sulfonyl)-1H-pyrazole-4-carboxamide
N-[(3-ethoxyphenyl)methyl]-1-methyl-3-(thiomorpholine-4-sulfonyl)-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | M461-0473 |
| Compound Name: | N-[(3-ethoxyphenyl)methyl]-1-methyl-3-(thiomorpholine-4-sulfonyl)-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 424.54 |
| Molecular Formula: | C18 H24 N4 O4 S2 |
| Smiles: | CCOc1cccc(CNC(c2cn(C)nc2S(N2CCSCC2)(=O)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 1.6846 |
| logD: | 1.6845 |
| logSw: | -2.6901 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.617 |
| InChI Key: | QQPQVIZRFUEBPY-UHFFFAOYSA-N |