Chemical Component Summary

Name2-(4-TERT-BUTYLPHENYL)-1H,2H,3H,4H-PYRIDO(2,3-D)PYRIMIDIN-4-ONE
Identifiers(2S)-2-(4-tert-butylphenyl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one
FormulaC17 H19 N3 O
Molecular Weight281.352
TypeNON-POLYMER
Isomeric SMILESCC(C)(C)c1ccc(cc1)[C@H]2Nc3c(cccn3)C(=O)N2
InChIInChI=1S/C17H19N3O/c1-17(2,3)12-8-6-11(7-9-12)14-19-15-13(16(21)20-14)5-4-10-18-15/h4-10,14H,1-3H3,(H,18,19)(H,20,21)/t14-/m0/s1
InChIKeyCFBOGZARBYDHCN-AWEZNQCLSA-N

Chemical Details

Formal Charge0
Atom Count40
Chiral Atom Count1
Bond Count42
Aromatic Bond Count12

Related Resource References

Resource NameReference
PubChem 91824281