4-bromo-2,6-dimethylphenyl 3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazole-5-carboxylate
Chemical Structure Depiction of
4-bromo-2,6-dimethylphenyl 3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazole-5-carboxylate
4-bromo-2,6-dimethylphenyl 3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazole-5-carboxylate
Compound characteristics
| Compound ID: | G784-0634 |
| Compound Name: | 4-bromo-2,6-dimethylphenyl 3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazole-5-carboxylate |
| Molecular Weight: | 441.34 |
| Molecular Formula: | C21 H17 Br N2 O2 S |
| Smiles: | Cc1cc(cc(C)c1OC(c1cc2c(C)nn(c3ccccc3)c2s1)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 6.5445 |
| logD: | 6.5445 |
| logSw: | -5.7443 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 35.564 |
| InChI Key: | MKOMYYSRMBNVFM-UHFFFAOYSA-N |