5-amino-3-(1-cyano-2-{3,5-dibromo-4-[(4-methylphenyl)methoxy]phenyl}ethenyl)-1-phenyl-1H-pyrazole-4-carbonitrile
Chemical Structure Depiction of
5-amino-3-(1-cyano-2-{3,5-dibromo-4-[(4-methylphenyl)methoxy]phenyl}ethenyl)-1-phenyl-1H-pyrazole-4-carbonitrile
5-amino-3-(1-cyano-2-{3,5-dibromo-4-[(4-methylphenyl)methoxy]phenyl}ethenyl)-1-phenyl-1H-pyrazole-4-carbonitrile
Compound characteristics
| Compound ID: | 8008-6044 |
| Compound Name: | 5-amino-3-(1-cyano-2-{3,5-dibromo-4-[(4-methylphenyl)methoxy]phenyl}ethenyl)-1-phenyl-1H-pyrazole-4-carbonitrile |
| Molecular Weight: | 589.29 |
| Molecular Formula: | C27 H19 Br2 N5 O |
| Smiles: | Cc1ccc(COc2c(cc(/C=C(C#N)/c3c(C#N)c(N)n(c4ccccc4)n3)cc2[Br])[Br])cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.3841 |
| logD: | 6.3841 |
| logSw: | -5.71 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.343 |
| InChI Key: | WHXVFHJEKYUCRU-UHFFFAOYSA-N |