5-amino-3-{2-[5-(4-bromophenyl)furan-2-yl]-1-cyanoethenyl}-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
Chemical Structure Depiction of
5-amino-3-{2-[5-(4-bromophenyl)furan-2-yl]-1-cyanoethenyl}-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
5-amino-3-{2-[5-(4-bromophenyl)furan-2-yl]-1-cyanoethenyl}-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
Compound characteristics
| Compound ID: | 8006-1636 |
| Compound Name: | 5-amino-3-{2-[5-(4-bromophenyl)furan-2-yl]-1-cyanoethenyl}-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile |
| Molecular Weight: | 424.25 |
| Molecular Formula: | C19 H14 Br N5 O2 |
| Smiles: | C(CO)n1c(c(C#N)c(/C(=C/c2ccc(c3ccc(cc3)[Br])o2)C#N)n1)N |
| Stereo: | ACHIRAL |
| logP: | 3.0173 |
| logD: | 3.0173 |
| logSw: | -3.097 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 92.281 |
| InChI Key: | PNJLDPUWRDDYCA-UHFFFAOYSA-N |