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141075-57-2 | L-Threoninamide, N-[(phenylmethoxy)carbonyl]glycyl-N-methyl-
CAS No: 141075-57-2 Catalog No: AG001FUT MDL No:
Product Description
Catalog Number:
AG001FUT
Chemical Name:
L-Threoninamide, N-[(phenylmethoxy)carbonyl]glycyl-N-methyl-
CAS Number:
141075-57-2
Molecular Formula:
C15H21N3O5
Molecular Weight:
323.3443
IUPAC Name:
benzyl N-[2-[[3-hydroxy-1-(methylamino)-1-oxobutan-2-yl]amino]-2-oxoethyl]carbamate
InChI:
InChI=1S/C15H21N3O5/c1-10(19)13(14(21)16-2)18-12(20)8-17-15(22)23-9-11-6-4-3-5-7-11/h3-7,10,13,19H,8-9H2,1-2H3,(H,16,21)(H,17,22)(H,18,20)
InChI Key:
GQWFEMWGBSRGJS-UHFFFAOYSA-N
SMILES:
CNC(=O)[C@H]([C@H](O)C)NC(=O)CNC(=O)OCc1ccccc1
Properties
Complexity:
410
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
323.148g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
323.349g/mol
Monoisotopic Mass:
323.148g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
117A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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