1-[4-(3,5-dimethyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazin-1-yl]-2-(4-ethoxyphenyl)ethan-1-one
Chemical Structure Depiction of
1-[4-(3,5-dimethyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazin-1-yl]-2-(4-ethoxyphenyl)ethan-1-one
1-[4-(3,5-dimethyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazin-1-yl]-2-(4-ethoxyphenyl)ethan-1-one
Compound characteristics
| Compound ID: | P664-0182 |
| Compound Name: | 1-[4-(3,5-dimethyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazin-1-yl]-2-(4-ethoxyphenyl)ethan-1-one |
| Molecular Weight: | 394.48 |
| Molecular Formula: | C21 H26 N6 O2 |
| Smiles: | CCOc1ccc(CC(N2CCN(CC2)c2cc(C)n3c(C)nnc3n2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.1515 |
| logD: | 2.1505 |
| logSw: | -2.5275 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 58.282 |
| InChI Key: | PYLMKEOPMFBBSA-UHFFFAOYSA-N |