1-{4-[3-(4-chlorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}-2-(4-fluorophenoxy)ethan-1-one
Chemical Structure Depiction of
1-{4-[3-(4-chlorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}-2-(4-fluorophenoxy)ethan-1-one
1-{4-[3-(4-chlorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}-2-(4-fluorophenoxy)ethan-1-one
Compound characteristics
| Compound ID: | G866-0637 |
| Compound Name: | 1-{4-[3-(4-chlorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}-2-(4-fluorophenoxy)ethan-1-one |
| Molecular Weight: | 467.89 |
| Molecular Formula: | C22 H19 Cl F N7 O2 |
| Smiles: | C1CN(CCN1C(COc1ccc(cc1)F)=O)c1c2c(ncn1)n(c1ccc(cc1)[Cl])nn2 |
| Stereo: | ACHIRAL |
| logP: | 3.0403 |
| logD: | 3.0403 |
| logSw: | -3.3137 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 74.053 |
| InChI Key: | ATZOLDHUAMYSIJ-UHFFFAOYSA-N |