N-[3-tert-butyl-1-(3-fluorophenyl)-1H-pyrazol-5-yl]-3-chloro-4-fluorobenzamide
Chemical Structure Depiction of
N-[3-tert-butyl-1-(3-fluorophenyl)-1H-pyrazol-5-yl]-3-chloro-4-fluorobenzamide
N-[3-tert-butyl-1-(3-fluorophenyl)-1H-pyrazol-5-yl]-3-chloro-4-fluorobenzamide
Compound characteristics
Compound ID: | V014-7728 |
Compound Name: | N-[3-tert-butyl-1-(3-fluorophenyl)-1H-pyrazol-5-yl]-3-chloro-4-fluorobenzamide |
Molecular Weight: | 389.83 |
Molecular Formula: | C20 H18 Cl F2 N3 O |
Smiles: | CC(C)(C)c1cc(NC(c2ccc(c(c2)[Cl])F)=O)n(c2cccc(c2)F)n1 |
Stereo: | ACHIRAL |
logP: | 5.5503 |
logD: | 4.7678 |
logSw: | -6.0434 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 37.765 |
InChI Key: | SAHWZTUDANDXJA-UHFFFAOYSA-N |