1-[4-(3-benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl)piperazin-1-yl]-2-(4-chlorophenyl)ethan-1-one
Chemical Structure Depiction of
1-[4-(3-benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl)piperazin-1-yl]-2-(4-chlorophenyl)ethan-1-one
1-[4-(3-benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl)piperazin-1-yl]-2-(4-chlorophenyl)ethan-1-one
Compound characteristics
| Compound ID: | G866-1138 |
| Compound Name: | 1-[4-(3-benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl)piperazin-1-yl]-2-(4-chlorophenyl)ethan-1-one |
| Molecular Weight: | 447.93 |
| Molecular Formula: | C23 H22 Cl N7 O |
| Smiles: | C(C(N1CCN(CC1)c1c2c(ncn1)n(Cc1ccccc1)nn2)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.402 |
| logD: | 3.4019 |
| logSw: | -3.5897 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 66.418 |
| InChI Key: | ASSXKPIYRCOYGI-UHFFFAOYSA-N |