2-[5,7-dimethyl-2-(3-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-1-(4-ethylpiperazin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-[5,7-dimethyl-2-(3-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-1-(4-ethylpiperazin-1-yl)ethan-1-one
2-[5,7-dimethyl-2-(3-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-1-(4-ethylpiperazin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | D458-0329 |
| Compound Name: | 2-[5,7-dimethyl-2-(3-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-1-(4-ethylpiperazin-1-yl)ethan-1-one |
| Molecular Weight: | 392.5 |
| Molecular Formula: | C22 H28 N6 O |
| Smiles: | CCN1CCN(CC1)C(Cc1c(C)nc2nc(c3cccc(C)c3)nn2c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4728 |
| logD: | 2.1776 |
| logSw: | -2.4908 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.762 |
| InChI Key: | PIEGAWUTFRSAGJ-UHFFFAOYSA-N |