5-methyl-2-(4-methylphenyl)-6-[2-(morpholin-4-yl)-2-oxoethyl]-4-(prop-2-en-1-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
5-methyl-2-(4-methylphenyl)-6-[2-(morpholin-4-yl)-2-oxoethyl]-4-(prop-2-en-1-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
5-methyl-2-(4-methylphenyl)-6-[2-(morpholin-4-yl)-2-oxoethyl]-4-(prop-2-en-1-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
Compound ID: | D584-0408 |
Compound Name: | 5-methyl-2-(4-methylphenyl)-6-[2-(morpholin-4-yl)-2-oxoethyl]-4-(prop-2-en-1-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
Molecular Weight: | 407.47 |
Molecular Formula: | C22 H25 N5 O3 |
Smiles: | [H]C([H])(C=C)N1C(C)=C(CC(N2CCOCC2)=O)C(n2c1nc(c1ccc(C)cc1)n2)=O |
Stereo: | ACHIRAL |
logP: | 2.516 |
logD: | 2.516 |
logSw: | -2.4508 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 62.762 |
InChI Key: | IFNYALIVPDIUOV-UHFFFAOYSA-N |