320417-90-1
4-(ISOPROPYLAMINO)-6-PHENYL-2-(4-PYRIDINYL)-5-PYRIMIDINECARBONITRILE
Name4-(ISOPROPYLAMINO)-6-PHENYL-2-(4-PYRIDINYL)-5-PYRIMIDINECARBONITRILE
1Identification
【Name】
4-(ISOPROPYLAMINO)-6-PHENYL-2-(4-PYRIDINYL)-5-PYRIMIDINECARBONITRILE
【CAS】
【MDL】
MFCD00139460
【English Synonyms】
【Formula】
C19 H17 N5
【MolWeight】
315.378
【Inchi】
InChI=1S/C19H17N5/c1-13(2)22-19-16(12-20)17(14-6-4-3-5-7-14)23-18(24-19)15-8-10-21-11-9-15/h3-11,13H,1-2H3,(H,22,23,24)
【InChIKey】
InChIKey=MYIIOVQWAUANOY-UHFFFAOYSA-N
【SMILES】
CC(C)Nc1c(c(nc(n1)c2ccncc2)c3ccccc3)C#N
【MOL File】
4-(ISOPROPYLAMINO)-6….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
4-(ISOPROPYLAMINO)-6-PHENYL-2-(4-PYRIDINYL)-5-PYRIMIDINECARBONITRILE.cml