5157-15-3
3A,6A-DIPHENYL-TETRAHYDRO-IMIDAZO[4,5-D]IMIDAZOLE-2,5-DIONE
Name3A,6A-DIPHENYL-TETRAHYDRO-IMIDAZO[4,5-D]IMIDAZOLE-2,5-DIONE
1Identification
【Name】
3A,6A-DIPHENYL-TETRAHYDRO-IMIDAZO[4,5-D]IMIDAZOLE-2,5-DIONE
【CAS】
【MDL】
MFCD00022615
【English Synonyms】
【Formula】
C16 H14 N4 O2
【MolWeight】
294.313
【Inchi】
InChI=1S/C16H14N4O2/c21-13-17-15(11-7-3-1-4-8-11)16(19-13,20-14(22)18-15)12-9-5-2-6-10-12/h1-10H,(H2,17,19,21)(H2,18,20,22)
【InChIKey】
InChIKey=WUDVGTHXCLJVJN-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)C23C(NC(=O)N2)(NC(=O)N3)c4ccccc4
【MOL File】
3A,6A-DIPHENYL-TETRA….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:4
H bond acceptor:6
XLogP3:1.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
3A,6A-DIPHENYL-TETRAHYDRO-IMIDAZO[4,5-D]IMIDAZOLE-2,5-DIONE.cml