3-(3,4-dimethoxyphenyl)-4-[4-(4-fluorobenzamido)phenyl]-1-(3-methylphenyl)-1H-pyrazol-5-yl acetate
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-4-[4-(4-fluorobenzamido)phenyl]-1-(3-methylphenyl)-1H-pyrazol-5-yl acetate
3-(3,4-dimethoxyphenyl)-4-[4-(4-fluorobenzamido)phenyl]-1-(3-methylphenyl)-1H-pyrazol-5-yl acetate
Compound characteristics
Compound ID: | V018-5921 |
Compound Name: | 3-(3,4-dimethoxyphenyl)-4-[4-(4-fluorobenzamido)phenyl]-1-(3-methylphenyl)-1H-pyrazol-5-yl acetate |
Molecular Weight: | 565.6 |
Molecular Formula: | C33 H28 F N3 O5 |
Smiles: | CC(=O)Oc1c(c2ccc(cc2)NC(c2ccc(cc2)F)=O)c(c2ccc(c(c2)OC)OC)nn1c1cccc(C)c1 |
Stereo: | ACHIRAL |
logP: | 6.324 |
logD: | 6.3236 |
logSw: | -5.6174 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.926 |
InChI Key: | SCFFPCNMCBJZHW-UHFFFAOYSA-N |