3-(4-fluorophenyl)-7-[4-(2,4,6-trimethylbenzene-1-sulfonyl)piperazin-1-yl]-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Chemical Structure Depiction of
3-(4-fluorophenyl)-7-[4-(2,4,6-trimethylbenzene-1-sulfonyl)piperazin-1-yl]-3H-[1,2,3]triazolo[4,5-d]pyrimidine
3-(4-fluorophenyl)-7-[4-(2,4,6-trimethylbenzene-1-sulfonyl)piperazin-1-yl]-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Compound characteristics
| Compound ID: | G867-0078 |
| Compound Name: | 3-(4-fluorophenyl)-7-[4-(2,4,6-trimethylbenzene-1-sulfonyl)piperazin-1-yl]-3H-[1,2,3]triazolo[4,5-d]pyrimidine |
| Molecular Weight: | 481.55 |
| Molecular Formula: | C23 H24 F N7 O2 S |
| Smiles: | Cc1cc(C)c(c(C)c1)S(N1CCN(CC1)c1c2c(ncn1)n(c1ccc(cc1)F)nn2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2096 |
| logD: | 4.2096 |
| logSw: | -4.2171 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 82.144 |
| InChI Key: | XOPHVVPMUHVRSX-UHFFFAOYSA-N |