4-bromo-3,5-dimethylphenyl 3-(4-chlorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxylate
Chemical Structure Depiction of
4-bromo-3,5-dimethylphenyl 3-(4-chlorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxylate
4-bromo-3,5-dimethylphenyl 3-(4-chlorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxylate
Compound characteristics
| Compound ID: | G784-0714 |
| Compound Name: | 4-bromo-3,5-dimethylphenyl 3-(4-chlorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxylate |
| Molecular Weight: | 475.79 |
| Molecular Formula: | C21 H16 Br Cl N2 O2 S |
| Smiles: | Cc1cc(cc(C)c1[Br])OC(c1cc2c(c3ccc(cc3)[Cl])nn(C)c2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.7873 |
| logD: | 6.7873 |
| logSw: | -6.4966 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 35.734 |
| InChI Key: | PAQGMYXWTXCDRG-UHFFFAOYSA-N |