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1608986-16-8 | D-Phenylalanine, N-(2-pyrazinylcarbonyl)-
CAS No: 1608986-16-8 Catalog No: AG001VG0 MDL No:
Product Description
Catalog Number:
AG001VG0
Chemical Name:
D-Phenylalanine, N-(2-pyrazinylcarbonyl)-
CAS Number:
1608986-16-8
Molecular Formula:
C14H13N3O3
Molecular Weight:
271.2713
IUPAC Name:
(2R)-3-phenyl-2-(pyrazine-2-carbonylamino)propanoic acid
InChI:
InChI=1S/C14H13N3O3/c18-13(12-9-15-6-7-16-12)17-11(14(19)20)8-10-4-2-1-3-5-10/h1-7,9,11H,8H2,(H,17,18)(H,19,20)/t11-/m1/s1
InChI Key:
DWYZPDHMMZGQAP-LLVKDONJSA-N
SMILES:
OC(=O)[C@H](NC(=O)c1nccnc1)Cc1ccccc1
Properties
Complexity:
343
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
271.096g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
271.276g/mol
Monoisotopic Mass:
271.096g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
92.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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