5-amino-3-{2-[5-(4-chlorophenyl)furan-2-yl]-1-cyanoethenyl}-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
Chemical Structure Depiction of
5-amino-3-{2-[5-(4-chlorophenyl)furan-2-yl]-1-cyanoethenyl}-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
5-amino-3-{2-[5-(4-chlorophenyl)furan-2-yl]-1-cyanoethenyl}-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
Compound characteristics
Compound ID: | 1809-0267 |
Compound Name: | 5-amino-3-{2-[5-(4-chlorophenyl)furan-2-yl]-1-cyanoethenyl}-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile |
Molecular Weight: | 379.8 |
Molecular Formula: | C19 H14 Cl N5 O2 |
Smiles: | [H]N([H])c1c(C#N)c(/C(=C/c2ccc(c3ccc(cc3)[Cl])o2)C#N)nn1CCO |
Stereo: | ACHIRAL |
logP: | 2.7781 |
logD: | 2.7781 |
logSw: | -3.6439 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 92.281 |
InChI Key: | UBTHXSRCVFGKQT-UHFFFAOYSA-N |