Home Carbonyls 7-(Tert-Butoxycarbonyl)-8-Methyl-5,6,7,8-Tetrahydroimidazo[1,2-A]Pyrazine-2-Carboxylic Acid

7-(Tert-Butoxycarbonyl)-8-Methyl-5,6,7,8-Tetrahydroimidazo[1,2-A]Pyrazine-2-Carboxylic Acid

CAS No.:
1824023-99-5
Catalog Number:
AG01DTIJ
Molecular Formula:
C13H19N3O4
Molecular Weight:
281.3077
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Product Description
Catalog Number:
AG01DTIJ
Chemical Name:
7-(Tert-Butoxycarbonyl)-8-Methyl-5,6,7,8-Tetrahydroimidazo[1,2-A]Pyrazine-2-Carboxylic Acid
CAS Number:
1824023-99-5
Molecular Formula:
C13H19N3O4
Molecular Weight:
281.3077
IUPAC Name:
8-methyl-7-[(2-methylpropan-2-yl)oxycarbonyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxylic acid
InChI:
InChI=1S/C13H19N3O4/c1-8-10-14-9(11(17)18)7-15(10)5-6-16(8)12(19)20-13(2,3)4/h7-8H,5-6H2,1-4H3,(H,17,18)
InChI Key:
KCEVXHWBGUZWKF-UHFFFAOYSA-N
SMILES:
O=C(N1CCn2c(C1C)nc(c2)C(=O)O)OC(C)(C)C
Properties
Complexity:
407  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.138g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
281.312g/mol
Monoisotopic Mass:
281.138g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
84.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties