2-methoxy-4-[5-methyl-6-(phenylcarbamoyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]phenyl benzoate
Chemical Structure Depiction of
2-methoxy-4-[5-methyl-6-(phenylcarbamoyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]phenyl benzoate
2-methoxy-4-[5-methyl-6-(phenylcarbamoyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]phenyl benzoate
Compound characteristics
Compound ID: | G856-1410 |
Compound Name: | 2-methoxy-4-[5-methyl-6-(phenylcarbamoyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]phenyl benzoate |
Molecular Weight: | 481.51 |
Molecular Formula: | C27 H23 N5 O4 |
Smiles: | CC1=C(C(c2ccc(c(c2)OC)OC(c2ccccc2)=O)n2c(N1)ncn2)C(Nc1ccccc1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.9285 |
logD: | 3.9266 |
logSw: | -4.1732 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 89.176 |
InChI Key: | GUMOIZIASRRDGT-DEOSSOPVSA-N |