5-amino-3-[1-cyano-2-(thiophen-2-yl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
Chemical Structure Depiction of
5-amino-3-[1-cyano-2-(thiophen-2-yl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
5-amino-3-[1-cyano-2-(thiophen-2-yl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
Compound characteristics
Compound ID: | 8007-2414 |
Compound Name: | 5-amino-3-[1-cyano-2-(thiophen-2-yl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile |
Molecular Weight: | 285.32 |
Molecular Formula: | C13 H11 N5 O S |
Smiles: | [H]N([H])c1c(C#N)c(/C(=C/c2cccs2)C#N)nn1CCO[H] |
Stereo: | ACHIRAL |
logP: | 0.5394 |
logD: | 0.5394 |
logSw: | -1.3159 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 85.73 |
InChI Key: | VPIRFXTWYRNZTE-UHFFFAOYSA-N |