2-(2-{4-[3-(3-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}-2-oxoethyl)-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-(2-{4-[3-(3-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}-2-oxoethyl)-1H-isoindole-1,3(2H)-dione
2-(2-{4-[3-(3-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}-2-oxoethyl)-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | G866-0532 |
| Compound Name: | 2-(2-{4-[3-(3-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}-2-oxoethyl)-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 486.46 |
| Molecular Formula: | C24 H19 F N8 O3 |
| Smiles: | C1CN(CCN1C(CN1C(c2ccccc2C1=O)=O)=O)c1c2c(ncn1)n(c1cccc(c1)F)nn2 |
| Stereo: | ACHIRAL |
| logP: | 1.8188 |
| logD: | 1.8188 |
| logSw: | -2.5924 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 96.079 |
| InChI Key: | YOQLTNJRYIHHMZ-UHFFFAOYSA-N |