5394-42-3
6-ETHYL-1-PHENYL-1,2-DIHYDRO-4H-PYRAZOLO[3,4-D]PYRIMIDIN-4-ONE
Name6-ETHYL-1-PHENYL-1,2-DIHYDRO-4H-PYRAZOLO[3,4-D]PYRIMIDIN-4-ONE
1Identification
【Name】
6-ETHYL-1-PHENYL-1,2-DIHYDRO-4H-PYRAZOLO[3,4-D]PYRIMIDIN-4-ONE
【CAS】
【MDL】
MFCD19707447
【English Synonyms】
【Formula】
C13 H12 N4 O
【MolWeight】
240.265
【Inchi】
InChI=1S/C13H12N4O/c1-2-11-15-12-10(13(18)16-11)8-14-17(12)9-6-4-3-5-7-9/h3-8,14H,2H2,1H3
【InChIKey】
InChIKey=CCSYEZAHWOQHGI-UHFFFAOYSA-N
【SMILES】
CCc1nc(=O)c-2c[nH]n(c2n1)c3ccccc3
【MOL File】
6-ETHYL-1-PHENYL-1,2….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
6-ETHYL-1-PHENYL-1,2-DIHYDRO-4H-PYRAZOLO[3,4-D]PYRIMIDIN-4-ONE.cml