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Home > Imidazoles > 160522-88-3
160522-88-3 | Pyrimidine, 2,4-bis[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-
CAS No: 160522-88-3 Catalog No: AG001S05 MDL No:
Product Description
Catalog Number:
AG001S05
Chemical Name:
Pyrimidine, 2,4-bis[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-
CAS Number:
160522-88-3
Molecular Formula:
C22H20N6
Molecular Weight:
368.4344
IUPAC Name:
2,4-bis[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]pyrimidine
InChI:
InChI=1S/C22H20N6/c1-3-16(20-24-11-12-25-20)4-2-15(1)19-9-10-23-22(28-19)18-7-5-17(6-8-18)21-26-13-14-27-21/h1-10H,11-14H2,(H,24,25)(H,26,27)
InChI Key:
XEGQNTSGTQJBLC-UHFFFAOYSA-N
SMILES:
c1cc(nc(n1)c1ccc(cc1)C1=NCCN1)c1ccc(cc1)C1=NCCN1
Properties
Complexity:
586
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
368.175g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
368.444g/mol
Monoisotopic Mass:
368.175g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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