1H-1-Benzazepine-1-acetic acid,3-[[(1S)-1-carboxy-3-phenylpropyl]amino]-2,3,4,5-tetrahydro-2-oxo-,(3S)-


Chemical Name: 1H-1-Benzazepine-1-acetic acid,3-[[(1S)-1-carboxy-3-phenylpropyl]amino]-2,3,4,5-tetrahydro-2-oxo-,(3S)-
CAS Number: 86541-78-8
Product Number: AG008FOL(AGN-PC-0V6G0O)
Synonyms:
MDL No: MFCD08060091
Molecular Formula: C22H24N2O5
Molecular Weight: 396.4364

Identification/Properties


Computed Properties
Molecular Weight:
396.443g/mol
XLogP3:
0.6
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
8
Exact Mass:
396.169g/mol
Monoisotopic Mass:
396.169g/mol
Topological Polar Surface Area:
107A^2
Heavy Atom Count:
29
Formal Charge:
0
Complexity:
590
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
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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