ethyl (5-methyl-7-{4-[2-(trifluoromethoxy)benzene-1-sulfonyl]piperazin-1-yl}[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)acetate
Chemical Structure Depiction of
ethyl (5-methyl-7-{4-[2-(trifluoromethoxy)benzene-1-sulfonyl]piperazin-1-yl}[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)acetate
ethyl (5-methyl-7-{4-[2-(trifluoromethoxy)benzene-1-sulfonyl]piperazin-1-yl}[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)acetate
Compound characteristics
| Compound ID: | V002-0273 |
| Compound Name: | ethyl (5-methyl-7-{4-[2-(trifluoromethoxy)benzene-1-sulfonyl]piperazin-1-yl}[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)acetate |
| Molecular Weight: | 528.51 |
| Molecular Formula: | C21 H23 F3 N6 O5 S |
| Salt: | not_available |
| Smiles: | CCOC(Cc1c(C)nc2ncnn2c1N1CCN(CC1)S(c1ccccc1OC(F)(F)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1758 |
| logD: | 3.0885 |
| logSw: | -3.4732 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 92.276 |
| InChI Key: | LUVLCKGGOSJENL-UHFFFAOYSA-N |