ethyl 5-{3-[3-(acetyloxy)-2-methylbenzamido]phenyl}-1-(4-methoxyphenyl)-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-{3-[3-(acetyloxy)-2-methylbenzamido]phenyl}-1-(4-methoxyphenyl)-1H-pyrazole-3-carboxylate
ethyl 5-{3-[3-(acetyloxy)-2-methylbenzamido]phenyl}-1-(4-methoxyphenyl)-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V002-9492 |
| Compound Name: | ethyl 5-{3-[3-(acetyloxy)-2-methylbenzamido]phenyl}-1-(4-methoxyphenyl)-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 513.55 |
| Molecular Formula: | C29 H27 N3 O6 |
| Smiles: | CCOC(c1cc(c2cccc(c2)NC(c2cccc(c2C)OC(C)=O)=O)n(c2ccc(cc2)OC)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2621 |
| logD: | 5.2621 |
| logSw: | -5.162 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.288 |
| InChI Key: | VVSACNZHXNATER-UHFFFAOYSA-N |