L-Leucine,N-[4-[[(2R)-2-amino-3-mercaptopropyl]amino]-2-(1-naphthalenyl)benzoyl]-, methyl ester


Chemical Name: L-Leucine,N-[4-[[(2R)-2-amino-3-mercaptopropyl]amino]-2-(1-naphthalenyl)benzoyl]-, methyl ester
CAS Number: 180977-44-0
Product Number: AG0022I0(AGN-PC-0QBXK7)
Synonyms:
MDL No: MFCD06409252
Molecular Formula: C27H33N3O3S
Molecular Weight: 479.6342

Identification/Properties


Computed Properties
Molecular Weight:
479.639g/mol
XLogP3:
5.1
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
11
Exact Mass:
479.224g/mol
Monoisotopic Mass:
479.224g/mol
Topological Polar Surface Area:
94.4A^2
Heavy Atom Count:
34
Formal Charge:
0
Complexity:
661
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

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NMR Spectrum


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