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622340-80-1 | 4-Pyridinecarboxamide,2-(1,1-dimethylethyl)-N-(5-methyl-3-isoxazolyl)-(9CI)
CAS No: 622340-80-1 Catalog No: AG00F99L MDL No:
Product Description
Catalog Number:
AG00F99L
Chemical Name:
4-Pyridinecarboxamide,2-(1,1-dimethylethyl)-N-(5-methyl-3-isoxazolyl)-(9CI)
CAS Number:
622340-80-1
IUPAC Name:
2-tert-butyl-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide
InChI:
InChI=1S/C14H17N3O2/c1-9-7-12(17-19-9)16-13(18)10-5-6-15-11(8-10)14(2,3)4/h5-8H,1-4H3,(H,16,17,18)
InChI Key:
XUKAEIYMDABTHZ-UHFFFAOYSA-N
Properties
Complexity:
327
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.132g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
259.309g/mol
Monoisotopic Mass:
259.132g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
68A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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