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173178-67-1 | L-Alaninamide, L-prolyl-L-prolyl-
CAS No: 173178-67-1 Catalog No: AG001YO7 MDL No:
Product Description
Catalog Number:
AG001YO7
Chemical Name:
L-Alaninamide, L-prolyl-L-prolyl-
CAS Number:
173178-67-1
Molecular Formula:
C13H22N4O3
Molecular Weight:
282.3388
IUPAC Name:
(2S)-N-[(2S)-1-amino-1-oxopropan-2-yl]-1-[(2S)-pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide
InChI:
InChI=1S/C13H22N4O3/c1-8(11(14)18)16-12(19)10-5-3-7-17(10)13(20)9-4-2-6-15-9/h8-10,15H,2-7H2,1H3,(H2,14,18)(H,16,19)/t8-,9-,10-/m0/s1
InChI Key:
JTOQGJMCFNSSMG-GUBZILKMSA-N
SMILES:
NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1)C
Properties
Complexity:
412
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
282.169g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
282.344g/mol
Monoisotopic Mass:
282.169g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9
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