N-cyclohexyl-N-methyl-2-[7-methyl-5-(2-methylanilino)-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-cyclohexyl-N-methyl-2-[7-methyl-5-(2-methylanilino)-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
N-cyclohexyl-N-methyl-2-[7-methyl-5-(2-methylanilino)-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | P572-4770 |
| Compound Name: | N-cyclohexyl-N-methyl-2-[7-methyl-5-(2-methylanilino)-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide |
| Molecular Weight: | 408.5 |
| Molecular Formula: | C22 H28 N6 O2 |
| Smiles: | CC1=CC2=NN(CC(N(C)C3CCCCC3)=O)C(N2C(Nc2ccccc2C)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9616 |
| logD: | 2.9614 |
| logSw: | -3.0929 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.894 |
| InChI Key: | LLHVVTJUCNUQIL-UHFFFAOYSA-N |