7-[4-(2,4-difluorobenzene-1-sulfonyl)piperazin-1-yl]-3-(4-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Chemical Structure Depiction of
7-[4-(2,4-difluorobenzene-1-sulfonyl)piperazin-1-yl]-3-(4-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine
7-[4-(2,4-difluorobenzene-1-sulfonyl)piperazin-1-yl]-3-(4-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Compound characteristics
| Compound ID: | G867-0088 |
| Compound Name: | 7-[4-(2,4-difluorobenzene-1-sulfonyl)piperazin-1-yl]-3-(4-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine |
| Molecular Weight: | 475.45 |
| Molecular Formula: | C20 H16 F3 N7 O2 S |
| Smiles: | C1CN(CCN1c1c2c(ncn1)n(c1ccc(cc1)F)nn2)S(c1ccc(cc1F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.977 |
| logD: | 2.9769 |
| logSw: | -3.2773 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 82.144 |
| InChI Key: | XWCWJESQSOVILL-UHFFFAOYSA-N |