N-butyl-N-(2-{[3-tert-butyl-1-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-2,4-dichlorobenzamide
Chemical Structure Depiction of
N-butyl-N-(2-{[3-tert-butyl-1-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-2,4-dichlorobenzamide
N-butyl-N-(2-{[3-tert-butyl-1-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-2,4-dichlorobenzamide
Compound characteristics
| Compound ID: | V009-1113 |
| Compound Name: | N-butyl-N-(2-{[3-tert-butyl-1-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-2,4-dichlorobenzamide |
| Molecular Weight: | 529.51 |
| Molecular Formula: | C28 H34 Cl2 N4 O2 |
| Smiles: | CCCCN(CC(Nc1cc(C(C)(C)C)nn1c1ccc(C)cc1C)=O)C(c1ccc(cc1[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 7.7387 |
| logD: | 7.7384 |
| logSw: | -6.5311 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.711 |
| InChI Key: | CDXQDVRXBAAGOA-UHFFFAOYSA-N |