1-{4-[3-(4-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}-2-(3-methylphenoxy)ethan-1-one
Chemical Structure Depiction of
1-{4-[3-(4-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}-2-(3-methylphenoxy)ethan-1-one
1-{4-[3-(4-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}-2-(3-methylphenoxy)ethan-1-one
Compound characteristics
Compound ID: | G866-0370 |
Compound Name: | 1-{4-[3-(4-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}-2-(3-methylphenoxy)ethan-1-one |
Molecular Weight: | 447.47 |
Molecular Formula: | C23 H22 F N7 O2 |
Smiles: | Cc1cccc(c1)OCC(N1CCN(CC1)c1c2c(ncn1)n(c1ccc(cc1)F)nn2)=O |
Stereo: | ACHIRAL |
logP: | 2.9369 |
logD: | 2.9368 |
logSw: | -3.0683 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 74.053 |
InChI Key: | WRWUOXYCKARYFY-UHFFFAOYSA-N |