1-{4-[3-(4-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}-2-(thiophen-2-yl)ethan-1-one
Chemical Structure Depiction of
1-{4-[3-(4-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}-2-(thiophen-2-yl)ethan-1-one
1-{4-[3-(4-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}-2-(thiophen-2-yl)ethan-1-one
Compound characteristics
| Compound ID: | G866-0773 |
| Compound Name: | 1-{4-[3-(4-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}-2-(thiophen-2-yl)ethan-1-one |
| Molecular Weight: | 435.51 |
| Molecular Formula: | C21 H21 N7 O2 S |
| Smiles: | COc1ccc(cc1)n1c2c(c(ncn2)N2CCN(CC2)C(Cc2cccs2)=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 2.4483 |
| logD: | 2.4483 |
| logSw: | -2.4748 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 75.116 |
| InChI Key: | ICBQFRGFVYIZIX-UHFFFAOYSA-N |