2-(3,4-dimethoxyphenyl)-1-{4-[3-(4-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(3,4-dimethoxyphenyl)-1-{4-[3-(4-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}ethan-1-one
2-(3,4-dimethoxyphenyl)-1-{4-[3-(4-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | G866-0378 |
| Compound Name: | 2-(3,4-dimethoxyphenyl)-1-{4-[3-(4-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 477.5 |
| Molecular Formula: | C24 H24 F N7 O3 |
| Smiles: | COc1ccc(CC(N2CCN(CC2)c2c3c(ncn2)n(c2ccc(cc2)F)nn3)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.5623 |
| logD: | 2.5622 |
| logSw: | -2.6914 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 81.815 |
| InChI Key: | PFAJUFLJOHEZFL-UHFFFAOYSA-N |