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Home > Pyridines > 145387-98-0
145387-98-0 | Pyridine, 2,6-bis(4,5-dihydro-1,5-diphenyl-1H-pyrazol-3-yl)-
CAS No: 145387-98-0 Catalog No: AG001KUZ MDL No:
Product Description
Catalog Number:
AG001KUZ
Chemical Name:
Pyridine, 2,6-bis(4,5-dihydro-1,5-diphenyl-1H-pyrazol-3-yl)-
CAS Number:
145387-98-0
Molecular Formula:
C35H29N5
Molecular Weight:
519.6383
IUPAC Name:
2,6-bis(2,3-diphenyl-3,4-dihydropyrazol-5-yl)pyridine
InChI:
InChI=1S/C35H29N5/c1-5-14-26(15-6-1)34-24-32(37-39(34)28-18-9-3-10-19-28)30-22-13-23-31(36-30)33-25-35(27-16-7-2-8-17-27)40(38-33)29-20-11-4-12-21-29/h1-23,34-35H,24-25H2
InChI Key:
KGBVXRJVCYLLLP-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)N1N=C(CC1c1ccccc1)c1cccc(n1)C1=NN(C(C1)c1ccccc1)c1ccccc1
Properties
Complexity:
804
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
519.242g/mol
Formal Charge:
0
Heavy Atom Count:
40
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
519.652g/mol
Monoisotopic Mass:
519.242g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
7.7
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