N-{4-[4-(methanesulfonyl)piperazin-1-yl]phenyl}-5-methyl-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
Chemical Structure Depiction of
N-{4-[4-(methanesulfonyl)piperazin-1-yl]phenyl}-5-methyl-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
N-{4-[4-(methanesulfonyl)piperazin-1-yl]phenyl}-5-methyl-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
Compound characteristics
Compound ID: | C301-7882 |
Compound Name: | N-{4-[4-(methanesulfonyl)piperazin-1-yl]phenyl}-5-methyl-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-amine |
Molecular Weight: | 463.56 |
Molecular Formula: | C23 H25 N7 O2 S |
Smiles: | Cc1cc(Nc2ccc(cc2)N2CCN(CC2)S(C)(=O)=O)n2c(n1)nc(c1ccccc1)n2 |
Stereo: | ACHIRAL |
logP: | 3.286 |
logD: | 3.2713 |
logSw: | -3.6126 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 74.576 |
InChI Key: | NRTFXNWWZDUKJH-UHFFFAOYSA-N |