4113-79-5
4,6-DIPHENYL-3,4-DIHYDRO-1H-PYRIMIDIN-2-ONE
Name4,6-DIPHENYL-3,4-DIHYDRO-1H-PYRIMIDIN-2-ONE
1Identification
【Name】
4,6-DIPHENYL-3,4-DIHYDRO-1H-PYRIMIDIN-2-ONE
【CAS】
【MDL】
MFCD00429604
【English Synonyms】
【Formula】
C16 H14 N2 O
【MolWeight】
250.3
【Inchi】
InChI=1S/C16H14N2O/c19-16-17-14(12-7-3-1-4-8-12)11-15(18-16)13-9-5-2-6-10-13/h1-11,14H,(H2,17,18,19)
【InChIKey】
InChIKey=DFTAAYUSFSEGNP-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)C2C=C(NC(=O)N2)c3ccccc3
【MOL File】
4,6-DIPHENYL-3,4-DIH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4,6-DIPHENYL-3,4-DIHYDRO-1H-PYRIMIDIN-2-ONE.cml