5-amino-3-(1-cyano-2-{3,5-dibromo-2-[(prop-2-en-1-yl)oxy]phenyl}ethenyl)-1H-pyrazole-4-carbonitrile
Chemical Structure Depiction of
5-amino-3-(1-cyano-2-{3,5-dibromo-2-[(prop-2-en-1-yl)oxy]phenyl}ethenyl)-1H-pyrazole-4-carbonitrile
5-amino-3-(1-cyano-2-{3,5-dibromo-2-[(prop-2-en-1-yl)oxy]phenyl}ethenyl)-1H-pyrazole-4-carbonitrile
Compound characteristics
| Compound ID: | 8010-2362 |
| Compound Name: | 5-amino-3-(1-cyano-2-{3,5-dibromo-2-[(prop-2-en-1-yl)oxy]phenyl}ethenyl)-1H-pyrazole-4-carbonitrile |
| Molecular Weight: | 449.1 |
| Molecular Formula: | C16 H11 Br2 N5 O |
| Smiles: | C=CCOc1c(/C=C(C#N)/c2c(C#N)c(N)[nH]n2)cc(cc1[Br])[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.9059 |
| logD: | 3.9025 |
| logSw: | -4.4528 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.899 |
| InChI Key: | RBZPMPAYRJFRNO-UHFFFAOYSA-N |