L-Proline,N-[[(2S,3S)-3-[(propylamino)carbonyl]oxiranyl]carbonyl]-L-isoleucyl-,methyl ester


Chemical Name: L-Proline,N-[[(2S,3S)-3-[(propylamino)carbonyl]oxiranyl]carbonyl]-L-isoleucyl-,methyl ester
CAS Number: 147859-80-1
Product Number: AG00AQ2Y(AGN-PC-0Q0YVN)
Synonyms:
MDL No: MFCD03452890
Molecular Formula: C19H31N3O6
Molecular Weight: 397.4659

Identification/Properties


Computed Properties
Molecular Weight:
397.472g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
10
Exact Mass:
397.221g/mol
Monoisotopic Mass:
397.221g/mol
Topological Polar Surface Area:
117A^2
Heavy Atom Count:
28
Formal Charge:
0
Complexity:
611
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
5
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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