N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-3,4-dichlorobenzamide
Chemical Structure Depiction of
N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-3,4-dichlorobenzamide
N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-3,4-dichlorobenzamide
Compound characteristics
| Compound ID: | V012-4042 |
| Compound Name: | N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-3,4-dichlorobenzamide |
| Molecular Weight: | 388.29 |
| Molecular Formula: | C20 H19 Cl2 N3 O |
| Smiles: | CC(C)(C)c1cc(NC(c2ccc(c(c2)[Cl])[Cl])=O)n(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.1024 |
| logD: | 5.9033 |
| logSw: | -6.1979 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.765 |
| InChI Key: | PDIYANDYBTZKLT-UHFFFAOYSA-N |