5-amino-3-{1-cyano-2-[5-(3-nitrophenyl)furan-2-yl]ethenyl}-1H-pyrazole-4-carbonitrile
Chemical Structure Depiction of
5-amino-3-{1-cyano-2-[5-(3-nitrophenyl)furan-2-yl]ethenyl}-1H-pyrazole-4-carbonitrile
5-amino-3-{1-cyano-2-[5-(3-nitrophenyl)furan-2-yl]ethenyl}-1H-pyrazole-4-carbonitrile
Compound characteristics
Compound ID: | 8010-2183 |
Compound Name: | 5-amino-3-{1-cyano-2-[5-(3-nitrophenyl)furan-2-yl]ethenyl}-1H-pyrazole-4-carbonitrile |
Molecular Weight: | 346.3 |
Molecular Formula: | C17 H10 N6 O3 |
Smiles: | C(=C(C#N)/c1c(C#N)c(N)[nH]n1)\c1ccc(c2cccc(c2)[N+]([O-])=O)o1 |
Stereo: | ACHIRAL |
logP: | 2.7866 |
logD: | 2.7821 |
logSw: | -3.2738 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 119.259 |
InChI Key: | WDLQTOOHRAJTSJ-UHFFFAOYSA-N |