7-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-3-(4-methylphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Chemical Structure Depiction of
7-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-3-(4-methylphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine
7-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-3-(4-methylphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Compound characteristics
| Compound ID: | G867-0041 |
| Compound Name: | 7-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-3-(4-methylphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine |
| Molecular Weight: | 453.5 |
| Molecular Formula: | C21 H20 F N7 O2 S |
| Smiles: | Cc1ccc(cc1)n1c2c(c(ncn2)N2CCN(CC2)S(c2ccc(cc2)F)(=O)=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 3.3593 |
| logD: | 3.3592 |
| logSw: | -3.5672 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 82.144 |
| InChI Key: | JPIHIZBPTQNOMW-UHFFFAOYSA-N |