1-(2,3-dimethylphenyl)-3-(2-fluorophenyl)-4-[4-(3-methylbutanamido)phenyl]-1H-pyrazol-5-yl acetate
Chemical Structure Depiction of
1-(2,3-dimethylphenyl)-3-(2-fluorophenyl)-4-[4-(3-methylbutanamido)phenyl]-1H-pyrazol-5-yl acetate
1-(2,3-dimethylphenyl)-3-(2-fluorophenyl)-4-[4-(3-methylbutanamido)phenyl]-1H-pyrazol-5-yl acetate
Compound characteristics
| Compound ID: | V015-3156 |
| Compound Name: | 1-(2,3-dimethylphenyl)-3-(2-fluorophenyl)-4-[4-(3-methylbutanamido)phenyl]-1H-pyrazol-5-yl acetate |
| Molecular Weight: | 499.59 |
| Molecular Formula: | C30 H30 F N3 O3 |
| Smiles: | CC(C)CC(Nc1ccc(cc1)c1c(c2ccccc2F)nn(c2cccc(C)c2C)c1OC(C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.8177 |
| logD: | 6.8177 |
| logSw: | -5.799 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.422 |
| InChI Key: | DQDBTPLANFXPIR-UHFFFAOYSA-N |