2-({[4-(4-chlorophenyl)-3-methyl-1H-pyrazol-5-yl]amino}methylidene)-5,5-dimethylcyclohexane-1,3-dione
Chemical Structure Depiction of
2-({[4-(4-chlorophenyl)-3-methyl-1H-pyrazol-5-yl]amino}methylidene)-5,5-dimethylcyclohexane-1,3-dione
2-({[4-(4-chlorophenyl)-3-methyl-1H-pyrazol-5-yl]amino}methylidene)-5,5-dimethylcyclohexane-1,3-dione
Compound characteristics
| Compound ID: | Y020-7377 |
| Compound Name: | 2-({[4-(4-chlorophenyl)-3-methyl-1H-pyrazol-5-yl]amino}methylidene)-5,5-dimethylcyclohexane-1,3-dione |
| Molecular Weight: | 357.84 |
| Molecular Formula: | C19 H20 Cl N3 O2 |
| Smiles: | Cc1c(c2ccc(cc2)[Cl])c(NC=C2C(CC(C)(C)CC2=O)=O)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 3.3172 |
| logD: | 2.9354 |
| logSw: | -4.2375 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.962 |
| InChI Key: | YEDMCQSYEAXODW-UHFFFAOYSA-N |