[1,2,4]Triazolo[4,3-a]quinolin-4-amine, 7-chloro-1-methyl-5-phenyl-


Chemical Name: [1,2,4]Triazolo[4,3-a]quinolin-4-amine, 7-chloro-1-methyl-5-phenyl-
CAS Number: 448950-89-8
Product Number: AG00DETQ(AGN-PC-0IHFAW)
Synonyms:
MDL No:
Molecular Formula: C17H13ClN4
Molecular Weight: 308.7649

Identification/Properties


Computed Properties
Molecular Weight:
308.769g/mol
XLogP3:
4.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
308.083g/mol
Monoisotopic Mass:
308.083g/mol
Topological Polar Surface Area:
56.2A^2
Heavy Atom Count:
22
Formal Charge:
0
Complexity:
400
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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