7-[4-(3-chlorobenzene-1-sulfonyl)piperazin-1-yl]-3-(4-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Chemical Structure Depiction of
7-[4-(3-chlorobenzene-1-sulfonyl)piperazin-1-yl]-3-(4-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine
7-[4-(3-chlorobenzene-1-sulfonyl)piperazin-1-yl]-3-(4-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Compound characteristics
| Compound ID: | G867-0087 |
| Compound Name: | 7-[4-(3-chlorobenzene-1-sulfonyl)piperazin-1-yl]-3-(4-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine |
| Molecular Weight: | 473.91 |
| Molecular Formula: | C20 H17 Cl F N7 O2 S |
| Smiles: | C1CN(CCN1c1c2c(ncn1)n(c1ccc(cc1)F)nn2)S(c1cccc(c1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5303 |
| logD: | 3.5303 |
| logSw: | -3.6397 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 82.144 |
| InChI Key: | BUAQARPQZKEIEC-UHFFFAOYSA-N |