3-(4-methylphenyl)-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-methylphenyl)-7-[4-(2,4,6-trimethylbenzene-1-sulfonyl)piperazin-1-yl]-3H-[1,2,3]triazolo[4,5-d]pyrimidine
3-(4-methylphenyl)-7-[4-(2,4,6-trimethylbenzene-1-sulfonyl)piperazin-1-yl]-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Compound characteristics
| Compound ID: | G867-0046 |
| Compound Name: | 3-(4-methylphenyl)-7-[4-(2,4,6-trimethylbenzene-1-sulfonyl)piperazin-1-yl]-3H-[1,2,3]triazolo[4,5-d]pyrimidine |
| Molecular Weight: | 477.59 |
| Molecular Formula: | C24 H27 N7 O2 S |
| Smiles: | Cc1ccc(cc1)n1c2c(c(ncn2)N2CCN(CC2)S(c2c(C)cc(C)cc2C)(=O)=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 4.604 |
| logD: | 4.6039 |
| logSw: | -4.3276 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 82.144 |
| InChI Key: | BPRBZZQFRZNXPU-UHFFFAOYSA-N |