ethyl 5-{3-[(1-benzothiophene-5-carbonyl)amino]phenyl}-1-(4-methoxyphenyl)-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-{3-[(1-benzothiophene-5-carbonyl)amino]phenyl}-1-(4-methoxyphenyl)-1H-pyrazole-3-carboxylate
ethyl 5-{3-[(1-benzothiophene-5-carbonyl)amino]phenyl}-1-(4-methoxyphenyl)-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V002-0060 |
| Compound Name: | ethyl 5-{3-[(1-benzothiophene-5-carbonyl)amino]phenyl}-1-(4-methoxyphenyl)-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 497.57 |
| Molecular Formula: | C28 H23 N3 O4 S |
| Smiles: | CCOC(c1cc(c2cccc(c2)NC(c2ccc3c(ccs3)c2)=O)n(c2ccc(cc2)OC)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.316 |
| logD: | 6.316 |
| logSw: | -5.781 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.197 |
| InChI Key: | KYWBVDPTMXSGFQ-UHFFFAOYSA-N |