1-(2,3-dimethylphenyl)-4-[4-(3-methoxybenzamido)phenyl]-3-(3-methylphenyl)-1H-pyrazol-5-yl acetate
Chemical Structure Depiction of
1-(2,3-dimethylphenyl)-4-[4-(3-methoxybenzamido)phenyl]-3-(3-methylphenyl)-1H-pyrazol-5-yl acetate
1-(2,3-dimethylphenyl)-4-[4-(3-methoxybenzamido)phenyl]-3-(3-methylphenyl)-1H-pyrazol-5-yl acetate
Compound characteristics
| Compound ID: | V005-8785 |
| Compound Name: | 1-(2,3-dimethylphenyl)-4-[4-(3-methoxybenzamido)phenyl]-3-(3-methylphenyl)-1H-pyrazol-5-yl acetate |
| Molecular Weight: | 545.64 |
| Molecular Formula: | C34 H31 N3 O4 |
| Smiles: | CC(=O)Oc1c(c2ccc(cc2)NC(c2cccc(c2)OC)=O)c(c2cccc(C)c2)nn1c1cccc(C)c1C |
| Stereo: | ACHIRAL |
| logP: | 7.5053 |
| logD: | 7.5053 |
| logSw: | -5.7398 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.908 |
| InChI Key: | ITBLUFDPEQGOFW-UHFFFAOYSA-N |