7-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-(furan-2-yl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
7-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-(furan-2-yl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine
7-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-(furan-2-yl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | G431-0298 |
| Compound Name: | 7-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-(furan-2-yl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 418.45 |
| Molecular Formula: | C22 H22 N6 O3 |
| Smiles: | Cc1cc(N2CCN(CC2)Cc2ccc3c(c2)OCO3)n2c(n1)nc(c1ccco1)n2 |
| Stereo: | ACHIRAL |
| logP: | 2.9442 |
| logD: | 2.1654 |
| logSw: | -2.8739 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.351 |
| InChI Key: | COKJUCVARLDLDI-UHFFFAOYSA-N |