Home Carboxys 1-[1,3]Oxazolo[4,5-b]pyridin-2-ylpiperidine-4-carboxylic acid

1-[1,3]Oxazolo[4,5-b]pyridin-2-ylpiperidine-4-carboxylic acid

CAS No.:
936074-71-4
Catalog Number:
AG00GVMW
Molecular Formula:
C12H13N3O3
Molecular Weight:
247.2499
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Product Description
Catalog Number:
AG00GVMW
Chemical Name:
1-[1,3]Oxazolo[4,5-b]pyridin-2-ylpiperidine-4-carboxylic acid
CAS Number:
936074-71-4
Molecular Formula:
C12H13N3O3
Molecular Weight:
247.2499
MDL Number:
MFCD09701681
IUPAC Name:
1-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperidine-4-carboxylic acid
InChI:
InChI=1S/C12H13N3O3/c16-11(17)8-3-6-15(7-4-8)12-14-10-9(18-12)2-1-5-13-10/h1-2,5,8H,3-4,6-7H2,(H,16,17)
InChI Key:
GKYOKNGSKMTPCN-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCN(CC1)c1nc2c(o1)cccn2
Properties
Complexity:
318  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.096g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
247.254g/mol
Monoisotopic Mass:
247.096g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
79.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties