ethyl 1-(3-bromophenyl)-5-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
ethyl 1-(3-bromophenyl)-5-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-1H-pyrazole-4-carboxylate
ethyl 1-(3-bromophenyl)-5-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | Y500-7905 |
| Compound Name: | ethyl 1-(3-bromophenyl)-5-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 504.79 |
| Molecular Formula: | C21 H15 Br Cl N3 O3 S |
| Smiles: | CCOC(c1cnn(c2cccc(c2)[Br])c1NC(c1c(c2ccccc2s1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3305 |
| logD: | 4.4719 |
| logSw: | -6.3268 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.567 |
| InChI Key: | QZLKACGHERGHDW-UHFFFAOYSA-N |