338394-14-2
5-[(BENZYLAMINO)METHYLENE]-1,3-DIMETHYL-2,4,6(1H,3H,5H)-PYRIMIDINETRIONE
Name5-[(BENZYLAMINO)METHYLENE]-1,3-DIMETHYL-2,4,6(1H,3H,5H)-PYRIMIDINETRIONE
1Identification
【Name】
5-[(BENZYLAMINO)METHYLENE]-1,3-DIMETHYL-2,4,6(1H,3H,5H)-PYRIMIDINETRIONE
【CAS】
【MDL】
MFCD00127313
【English Synonyms】
【Formula】
C14 H15 N3 O3
【MolWeight】
273.29
【Inchi】
InChI=1S/C14H15N3O3/c1-16-12(18)11(13(19)17(2)14(16)20)9-15-8-10-6-4-3-5-7-10/h3-7,9,15H,8H2,1-2H3
【InChIKey】
InChIKey=YJKMMFLHVRELSR-UHFFFAOYSA-N
【SMILES】
CN1C(=O)C(=CNCc2ccccc2)C(=O)N(C1=O)C
【MOL File】
5-[(BENZYLAMINO)METH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5-[(BENZYLAMINO)METHYLENE]-1,3-DIMETHYL-2,4,6(1H,3H,5H)-PYRIMIDINETRIONE.cml