N-[3,4-dihydro-1(2H)-quinolinylcarbothioyl]benzenecarboxamide


Chemical Name: N-[3,4-dihydro-1(2H)-quinolinylcarbothioyl]benzenecarboxamide
CAS Number: 25561-81-3
Product Number: AG00IWAI(AGN-PC-0WAQIC)
Synonyms:
MDL No: MFCD00585527
Molecular Formula: C17H16N2OS
Molecular Weight: 296.3867

Identification/Properties


Computed Properties
Molecular Weight:
296.388g/mol
XLogP3:
3.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
296.098g/mol
Monoisotopic Mass:
296.098g/mol
Topological Polar Surface Area:
64.4A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
392
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

Safety Information


NMR Spectrum


Other Analytical Data


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