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102033-88-5 | 1H-Pyrazol-3-amine, N-(methylphenyl)-1,5-diphenyl- (9CI)
CAS No: 102033-88-5 Catalog No: AG0006FT MDL No:
Product Description
Catalog Number:
AG0006FT
Chemical Name:
1H-Pyrazol-3-amine, N-(methylphenyl)-1,5-diphenyl- (9CI)
CAS Number:
102033-88-5
Molecular Formula:
C22H19N3
Molecular Weight:
325.4064
IUPAC Name:
N-(2-methylphenyl)-1,5-diphenylpyrazol-3-amine
InChI:
InChI=1S/C22H19N3/c1-17-10-8-9-15-20(17)23-22-16-21(18-11-4-2-5-12-18)25(24-22)19-13-6-3-7-14-19/h2-16H,1H3,(H,23,24)
InChI Key:
WVRXNLQRSUECLG-UHFFFAOYSA-N
SMILES:
Cc1ccccc1Nc1cc(n(n1)c1ccccc1)c1ccccc1
Properties
Complexity:
400
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.158g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
325.415g/mol
Monoisotopic Mass:
325.158g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
29.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8
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