N-[3-tert-butyl-1-(2-chlorophenyl)-1H-pyrazol-5-yl]-2-chloro-4-fluorobenzamide
Chemical Structure Depiction of
N-[3-tert-butyl-1-(2-chlorophenyl)-1H-pyrazol-5-yl]-2-chloro-4-fluorobenzamide
N-[3-tert-butyl-1-(2-chlorophenyl)-1H-pyrazol-5-yl]-2-chloro-4-fluorobenzamide
Compound characteristics
| Compound ID: | V012-5541 |
| Compound Name: | N-[3-tert-butyl-1-(2-chlorophenyl)-1H-pyrazol-5-yl]-2-chloro-4-fluorobenzamide |
| Molecular Weight: | 406.29 |
| Molecular Formula: | C20 H18 Cl2 F N3 O |
| Smiles: | CC(C)(C)c1cc(NC(c2ccc(cc2[Cl])F)=O)n(c2ccccc2[Cl])n1 |
| Stereo: | ACHIRAL |
| logP: | 6.0232 |
| logD: | 5.2408 |
| logSw: | -6.1013 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.464 |
| InChI Key: | RMVRXXHDVIBIGQ-UHFFFAOYSA-N |