872494-03-6
2,6-BIS-BENZYLAMINO-4-(4-HYDROXY-PHENYL)-PYRIDINE-3,5-DICARBONITRILE
Name2,6-BIS-BENZYLAMINO-4-(4-HYDROXY-PHENYL)-PYRIDINE-3,5-DICARBONITRILE
1Identification
【Name】
2,6-BIS-BENZYLAMINO-4-(4-HYDROXY-PHENYL)-PYRIDINE-3,5-DICARBONITRILE
【CAS】
【MDL】
MFCD15833324
【English Synonyms】
【Formula】
C27H21N5O
【MolWeight】
431.497
【Inchi】
InChI=1S/C27H21N5O/c28-15-23-25(21-11-13-22(33)14-12-21)24(16-29)27(31-18-20-9-5-2-6-10-20)32-26(23)30-17-19-7-3-1-4-8-19/h1-14,33H,17-18H2,(H2,30,31,32)
【InChIKey】
InChIKey=JVPMXDXWDCXZEY-UHFFFAOYSA-N
【SMILES】
C(C1=CC=CC=C1)NC1=NC(=C(C(=C1C#N)C1=CC=C(C=C1)O)C#N)NCC1=CC=CC=C1
【MOL File】
2,6-BIS-BENZYLAMINO-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:6
XLogP3:5.0931
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2,6-BIS-BENZYLAMINO-4-(4-HYDROXY-PHENYL)-PYRIDINE-3,5-DICARBONITRILE.cml