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128550-47-0 | L-Phenylalaninamide, N-acetyl-L-valyl-
CAS No: 128550-47-0 Catalog No: AG000Y6W MDL No:
Product Description
Catalog Number:
AG000Y6W
Chemical Name:
L-Phenylalaninamide, N-acetyl-L-valyl-
CAS Number:
128550-47-0
Molecular Formula:
C16H23N3O3
Molecular Weight:
305.3721
IUPAC Name:
2-acetamido-N-(1-amino-1-oxo-3-phenylpropan-2-yl)-3-methylbutanamide
InChI:
InChI=1S/C16H23N3O3/c1-10(2)14(18-11(3)20)16(22)19-13(15(17)21)9-12-7-5-4-6-8-12/h4-8,10,13-14H,9H2,1-3H3,(H2,17,21)(H,18,20)(H,19,22)
InChI Key:
MYWASWVEXQLQLP-UHFFFAOYSA-N
SMILES:
CC(=O)N[C@H](C(=O)N[C@H](C(=O)N)Cc1ccccc1)C(C)C
Properties
Complexity:
403
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.174g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
305.378g/mol
Monoisotopic Mass:
305.174g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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