7-[(4-chlorophenyl)methyl]-2-phenylpyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Chemical Structure Depiction of
7-[(4-chlorophenyl)methyl]-2-phenylpyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
7-[(4-chlorophenyl)methyl]-2-phenylpyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Compound characteristics
Compound ID: | D718-0833 |
Compound Name: | 7-[(4-chlorophenyl)methyl]-2-phenylpyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one |
Molecular Weight: | 387.83 |
Molecular Formula: | C21 H14 Cl N5 O |
Smiles: | C(c1ccc(cc1)[Cl])N1C=CC2=C(C=Nc3nc(c4ccccc4)nn23)C1=O |
Stereo: | ACHIRAL |
logP: | 3.6472 |
logD: | 3.6472 |
logSw: | -4.1915 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 50.537 |
InChI Key: | BFPZAEFLZHXTCQ-UHFFFAOYSA-N |