2-(4-tert-butylphenyl)-4-{[2-(3-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Chemical Structure Depiction of
2-(4-tert-butylphenyl)-4-{[2-(3-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
2-(4-tert-butylphenyl)-4-{[2-(3-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Compound characteristics
| Compound ID: | G199-1643 |
| Compound Name: | 2-(4-tert-butylphenyl)-4-{[2-(3-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one |
| Molecular Weight: | 439.58 |
| Molecular Formula: | C23 H29 N5 O2 S |
| Smiles: | CC1CCCN(C1)C(CSC1=NC(c2ccc(cc2)C(C)(C)C)=NC2=CC(NN12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1473 |
| logD: | 4.1473 |
| logSw: | -4.0073 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.259 |
| InChI Key: | RZUIZIIRYGQPSF-HNNXBMFYSA-N |