5-amino-3-{1-cyano-2-[5-(2-nitrophenyl)furan-2-yl]ethenyl}-1-phenyl-1H-pyrazole-4-carbonitrile
Chemical Structure Depiction of
5-amino-3-{1-cyano-2-[5-(2-nitrophenyl)furan-2-yl]ethenyl}-1-phenyl-1H-pyrazole-4-carbonitrile
5-amino-3-{1-cyano-2-[5-(2-nitrophenyl)furan-2-yl]ethenyl}-1-phenyl-1H-pyrazole-4-carbonitrile
Compound characteristics
| Compound ID: | 8007-8023 |
| Compound Name: | 5-amino-3-{1-cyano-2-[5-(2-nitrophenyl)furan-2-yl]ethenyl}-1-phenyl-1H-pyrazole-4-carbonitrile |
| Molecular Weight: | 422.4 |
| Molecular Formula: | C23 H14 N6 O3 |
| Smiles: | C(=C(C#N)/c1c(C#N)c(N)n(c2ccccc2)n1)\c1ccc(c2ccccc2[N+]([O-])=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.8558 |
| logD: | 3.8558 |
| logSw: | -4.6308 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 108.592 |
| InChI Key: | ROMNURDJRFJDRK-UHFFFAOYSA-N |