1-(2,5-dimethylphenyl)-3-(3-methylphenyl)-4-[4-(2-phenylacetamido)phenyl]-1H-pyrazol-5-yl acetate
Chemical Structure Depiction of
1-(2,5-dimethylphenyl)-3-(3-methylphenyl)-4-[4-(2-phenylacetamido)phenyl]-1H-pyrazol-5-yl acetate
1-(2,5-dimethylphenyl)-3-(3-methylphenyl)-4-[4-(2-phenylacetamido)phenyl]-1H-pyrazol-5-yl acetate
Compound characteristics
| Compound ID: | V003-8664 |
| Compound Name: | 1-(2,5-dimethylphenyl)-3-(3-methylphenyl)-4-[4-(2-phenylacetamido)phenyl]-1H-pyrazol-5-yl acetate |
| Molecular Weight: | 529.64 |
| Molecular Formula: | C34 H31 N3 O3 |
| Smiles: | CC(=O)Oc1c(c2ccc(cc2)NC(Cc2ccccc2)=O)c(c2cccc(C)c2)nn1c1cc(C)ccc1C |
| Stereo: | ACHIRAL |
| logP: | 7.3959 |
| logD: | 7.3959 |
| logSw: | -5.7135 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.151 |
| InChI Key: | WTWZTCZQYYKLBZ-UHFFFAOYSA-N |