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130090-18-5 | Benzenamine, 4-(4,6-diphenyl-2-pyrimidinyl)-
CAS No: 130090-18-5 Catalog No: AG000TZP MDL No:
Product Description
Catalog Number:
AG000TZP
Chemical Name:
Benzenamine, 4-(4,6-diphenyl-2-pyrimidinyl)-
CAS Number:
130090-18-5
Molecular Formula:
C22H17N3
Molecular Weight:
323.3905
IUPAC Name:
4-(4,6-diphenylpyrimidin-2-yl)aniline
InChI:
InChI=1S/C22H17N3/c23-19-13-11-18(12-14-19)22-24-20(16-7-3-1-4-8-16)15-21(25-22)17-9-5-2-6-10-17/h1-15H,23H2
InChI Key:
MBNJYUMUJTXOGL-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)c1nc(cc(n1)c1ccccc1)c1ccccc1
Properties
Complexity:
366
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
323.142g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
323.399g/mol
Monoisotopic Mass:
323.142g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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