Urea,N-[(3R)-2,3-dihydro-1-[2-(2-methylphenyl)-2-oxoethyl]-2-oxo-5-phenyl-1H-1,4-benzodiazepin-3-yl]-N'-(3-methylphenyl)-


Chemical Name: Urea,N-[(3R)-2,3-dihydro-1-[2-(2-methylphenyl)-2-oxoethyl]-2-oxo-5-phenyl-1H-1,4-benzodiazepin-3-yl]-N'-(3-methylphenyl)-
CAS Number: 145084-28-2
Product Number: AG001KJD(AGN-PC-0PWLNP)
Synonyms:
MDL No: MFCD00917023
Molecular Formula: C32H28N4O3
Molecular Weight: 516.5897

Identification/Properties


Computed Properties
Molecular Weight:
516.601g/mol
XLogP3:
5.6
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
6
Exact Mass:
516.216g/mol
Monoisotopic Mass:
516.216g/mol
Topological Polar Surface Area:
90.9A^2
Heavy Atom Count:
39
Formal Charge:
0
Complexity:
913
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
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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