1-[3-(3,4-dimethoxyphenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carbonyl]piperidine-4-carbonitrile
Chemical Structure Depiction of
1-[3-(3,4-dimethoxyphenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carbonyl]piperidine-4-carbonitrile
1-[3-(3,4-dimethoxyphenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carbonyl]piperidine-4-carbonitrile
Compound characteristics
| Compound ID: | C066-3006 |
| Compound Name: | 1-[3-(3,4-dimethoxyphenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carbonyl]piperidine-4-carbonitrile |
| Molecular Weight: | 410.49 |
| Molecular Formula: | C21 H22 N4 O3 S |
| Smiles: | Cn1c2c(cc(C(N3CCC(CC3)C#N)=O)s2)c(c2ccc(c(c2)OC)OC)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.5717 |
| logD: | 2.5717 |
| logSw: | -2.7957 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 64.322 |
| InChI Key: | KHGSXKAFSKNSNH-UHFFFAOYSA-N |