4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-5-methyl-2-(2-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-5-methyl-2-(2-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-5-methyl-2-(2-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D475-1408 |
| Compound Name: | 4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-5-methyl-2-(2-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 394.48 |
| Molecular Formula: | C21 H26 N6 O2 |
| Smiles: | CCN1CCN(CC1)C(CN1C(C)=CC(n2c1nc(c1ccccc1C)n2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5344 |
| logD: | 1.3582 |
| logSw: | -2.3287 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.274 |
| InChI Key: | NUZMLXZMMNZFQY-UHFFFAOYSA-N |