1253789-18-2
1-METHYL-7-PHENYL-1H-PYRIMIDO[4,5-D][1,3]OXAZINE-2,4-DIONE
Name1-METHYL-7-PHENYL-1H-PYRIMIDO[4,5-D][1,3]OXAZINE-2,4-DIONE
1Identification
【Name】
1-METHYL-7-PHENYL-1H-PYRIMIDO[4,5-D][1,3]OXAZINE-2,4-DIONE
【CAS】
【MDL】
MFCD17011948
【English Synonyms】
【Formula】
C13 H9 N3 O3
【MolWeight】
255.232
【Inchi】
InChI=1S/C13H9N3O3/c1-16-11-9(12(17)19-13(16)18)7-14-10(15-11)8-5-3-2-4-6-8/h2-7H,1H3
【InChIKey】
InChIKey=YTXVVCNUUMAUNS-UHFFFAOYSA-N
【SMILES】
Cn1c2c(cnc(n2)c3ccccc3)c(=O)oc1=O
【MOL File】
1-METHYL-7-PHENYL-1H….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:6
XLogP3:3.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
1-METHYL-7-PHENYL-1H-PYRIMIDO[4,5-D][1,3]OXAZINE-2,4-DIONE.cml