L-Histidine,N-[(1,1-dimethylethoxy)carbonyl]-1-[(4-methylphenyl)sulfonyl]-


Chemical Name: L-Histidine,N-[(1,1-dimethylethoxy)carbonyl]-1-[(4-methylphenyl)sulfonyl]-
CAS Number: 35899-43-5
Product Number: AG00I745(AGN-PC-0RBCKB)
Synonyms:
MDL No:
Molecular Formula: C18H23N3O6S
Molecular Weight: 409.4567

Identification/Properties


Computed Properties
Molecular Weight:
409.457g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
8
Exact Mass:
409.131g/mol
Monoisotopic Mass:
409.131g/mol
Topological Polar Surface Area:
136A^2
Heavy Atom Count:
28
Formal Charge:
0
Complexity:
662
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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