5-amino-3-[1-cyano-2-(2,3-dichlorophenyl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
Chemical Structure Depiction of
5-amino-3-[1-cyano-2-(2,3-dichlorophenyl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
5-amino-3-[1-cyano-2-(2,3-dichlorophenyl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
Compound characteristics
| Compound ID: | 8007-4993 |
| Compound Name: | 5-amino-3-[1-cyano-2-(2,3-dichlorophenyl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile |
| Molecular Weight: | 348.19 |
| Molecular Formula: | C15 H11 Cl2 N5 O |
| Smiles: | C(CO)n1c(c(C#N)c(/C(=C/c2cccc(c2[Cl])[Cl])C#N)n1)N |
| Stereo: | ACHIRAL |
| logP: | 2.1175 |
| logD: | 2.1175 |
| logSw: | -2.9334 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.711 |
| InChI Key: | CBKZKHFZSJPGML-UHFFFAOYSA-N |