2-(3,5-dimethoxyphenyl)-1-{4-[5-(propan-2-yl)[1,2,4]triazolo[4,3-a]pyrimidin-7-yl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(3,5-dimethoxyphenyl)-1-{4-[5-(propan-2-yl)[1,2,4]triazolo[4,3-a]pyrimidin-7-yl]piperazin-1-yl}ethan-1-one
2-(3,5-dimethoxyphenyl)-1-{4-[5-(propan-2-yl)[1,2,4]triazolo[4,3-a]pyrimidin-7-yl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | P664-1337 |
| Compound Name: | 2-(3,5-dimethoxyphenyl)-1-{4-[5-(propan-2-yl)[1,2,4]triazolo[4,3-a]pyrimidin-7-yl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 424.5 |
| Molecular Formula: | C22 H28 N6 O3 |
| Smiles: | CC(C)c1cc(nc2nncn12)N1CCN(CC1)C(Cc1cc(cc(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7222 |
| logD: | 2.7222 |
| logSw: | -2.9706 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.104 |
| InChI Key: | GKPMWWOMGQPBEG-UHFFFAOYSA-N |