5-methyl-N-(2-methyl-5-nitrophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
Chemical Structure Depiction of
5-methyl-N-(2-methyl-5-nitrophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
5-methyl-N-(2-methyl-5-nitrophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
Compound characteristics
Compound ID: | 8010-2197 |
Compound Name: | 5-methyl-N-(2-methyl-5-nitrophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-amine |
Molecular Weight: | 284.27 |
Molecular Formula: | C13 H12 N6 O2 |
Smiles: | Cc1ccc(cc1Nc1cc(C)nc2ncnn12)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 2.1488 |
logD: | 2.1471 |
logSw: | -2.4883 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 73.736 |
InChI Key: | VHVSUUPWHABWPC-UHFFFAOYSA-N |