1-([1,4'-bipiperidin]-1'-yl)-2-{[3-(2-methoxyphenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl]sulfanyl}ethan-1-one
Chemical Structure Depiction of
1-([1,4'-bipiperidin]-1'-yl)-2-{[3-(2-methoxyphenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl]sulfanyl}ethan-1-one
1-([1,4'-bipiperidin]-1'-yl)-2-{[3-(2-methoxyphenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | C788-0996 |
| Compound Name: | 1-([1,4'-bipiperidin]-1'-yl)-2-{[3-(2-methoxyphenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl]sulfanyl}ethan-1-one |
| Molecular Weight: | 493.67 |
| Molecular Formula: | C27 H35 N5 O2 S |
| Smiles: | Cc1cc(n2c(c(c3ccccc3OC)c(C)n2)n1)SCC(N1CCC(CC1)N1CCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4407 |
| logD: | -0.1149 |
| logSw: | -3.8414 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.393 |
| InChI Key: | ZVSHLSMKNQQKSR-UHFFFAOYSA-N |