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102638-71-1 | L-Phenylalaninamide, L-isoleucyl-
CAS No: 102638-71-1 Catalog No: AG0007ZQ MDL No:
Product Description
Catalog Number:
AG0007ZQ
Chemical Name:
L-Phenylalaninamide, L-isoleucyl-
CAS Number:
102638-71-1
Molecular Formula:
C15H23N3O2
Molecular Weight:
277.3620
IUPAC Name:
(2S,3S)-2-amino-N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-3-methylpentanamide
InChI:
InChI=1S/C15H23N3O2/c1-3-10(2)13(16)15(20)18-12(14(17)19)9-11-7-5-4-6-8-11/h4-8,10,12-13H,3,9,16H2,1-2H3,(H2,17,19)(H,18,20)/t10-,12-,13-/m0/s1
InChI Key:
GBVAMMGFBVZXEA-DRZSPHRISA-N
SMILES:
CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N)Cc1ccccc1)N)C
Properties
Complexity:
327
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
277.179g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
277.368g/mol
Monoisotopic Mass:
277.179g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
98.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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