Home Carbonyls (R)-3-((tert-Butoxycarbonyl)amino)-4-(pyridin-4-yl)butanoic acid

(R)-3-((tert-Butoxycarbonyl)amino)-4-(pyridin-4-yl)butanoic acid

CAS No.:
269396-68-1
Catalog Number:
AG003OEP
Molecular Formula:
C14H20N2O4
Molecular Weight:
280.3196
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Product Description
Catalog Number:
AG003OEP
Chemical Name:
(R)-3-((tert-Butoxycarbonyl)amino)-4-(pyridin-4-yl)butanoic acid
CAS Number:
269396-68-1
Molecular Formula:
C14H20N2O4
Molecular Weight:
280.3196
MDL Number:
MFCD01076287
IUPAC Name:
(3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-pyridin-4-ylbutanoic acid
InChI:
InChI=1S/C14H20N2O4/c1-14(2,3)20-13(19)16-11(9-12(17)18)8-10-4-6-15-7-5-10/h4-7,11H,8-9H2,1-3H3,(H,16,19)(H,17,18)/t11-/m1/s1
InChI Key:
BYTKQINZDKLYGV-LLVKDONJSA-N
SMILES:
OC(=O)C[C@@H](Cc1ccncc1)NC(=O)OC(C)(C)C
Properties
Complexity:
333  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
280.142g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
280.324g/mol
Monoisotopic Mass:
280.142g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
88.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties