6-benzyl-5-methyl-7-{4-[4-(2-methylbutan-2-yl)benzene-1-sulfonyl]piperazin-1-yl}[1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
6-benzyl-5-methyl-7-{4-[4-(2-methylbutan-2-yl)benzene-1-sulfonyl]piperazin-1-yl}[1,2,4]triazolo[1,5-a]pyrimidine
6-benzyl-5-methyl-7-{4-[4-(2-methylbutan-2-yl)benzene-1-sulfonyl]piperazin-1-yl}[1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | V004-2197 |
| Compound Name: | 6-benzyl-5-methyl-7-{4-[4-(2-methylbutan-2-yl)benzene-1-sulfonyl]piperazin-1-yl}[1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 518.68 |
| Molecular Formula: | C28 H34 N6 O2 S |
| Salt: | not_available |
| Smiles: | CCC(C)(C)c1ccc(cc1)S(N1CCN(CC1)c1c(Cc2ccccc2)c(C)nc2ncnn12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6421 |
| logD: | 5.6065 |
| logSw: | -5.6565 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.822 |
| InChI Key: | SPAVAJOVYZOWKJ-UHFFFAOYSA-N |