4-pentanoylphenyl 3-(4-chlorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxylate
Chemical Structure Depiction of
4-pentanoylphenyl 3-(4-chlorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxylate
4-pentanoylphenyl 3-(4-chlorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxylate
Compound characteristics
| Compound ID: | G784-0723 |
| Compound Name: | 4-pentanoylphenyl 3-(4-chlorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxylate |
| Molecular Weight: | 452.96 |
| Molecular Formula: | C24 H21 Cl N2 O3 S |
| Smiles: | CCCCC(c1ccc(cc1)OC(c1cc2c(c3ccc(cc3)[Cl])nn(C)c2s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0984 |
| logD: | 6.0984 |
| logSw: | -6.1697 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.981 |
| InChI Key: | BQQNZGFSUUTCIK-UHFFFAOYSA-N |