5-amino-3-{2-[5-(5-chloro-2-methoxyphenyl)furan-2-yl]-1-cyanoethenyl}-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
Chemical Structure Depiction of
5-amino-3-{2-[5-(5-chloro-2-methoxyphenyl)furan-2-yl]-1-cyanoethenyl}-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
5-amino-3-{2-[5-(5-chloro-2-methoxyphenyl)furan-2-yl]-1-cyanoethenyl}-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
Compound characteristics
| Compound ID: | 2367-1099 |
| Compound Name: | 5-amino-3-{2-[5-(5-chloro-2-methoxyphenyl)furan-2-yl]-1-cyanoethenyl}-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile |
| Molecular Weight: | 409.83 |
| Molecular Formula: | C20 H16 Cl N5 O3 |
| Smiles: | [H]N([H])c1c(C#N)c(/C(=C/c2ccc(c3cc(ccc3OC)[Cl])o2)C#N)nn1CCO[H] |
| Stereo: | ACHIRAL |
| logP: | 2.5744 |
| logD: | 2.5744 |
| logSw: | -3.3612 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 99.911 |
| InChI Key: | MCQMDKAVUNWPGX-UHFFFAOYSA-N |