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82558-97-2 | Benzamide, 2,6-dimethoxy-N-[3-(1-methylethyl)-5-isoxazolyl]-
CAS No: 82558-97-2 Catalog No: AG004YQT MDL No:
Product Description
Catalog Number:
AG004YQT
Chemical Name:
Benzamide, 2,6-dimethoxy-N-[3-(1-methylethyl)-5-isoxazolyl]-
CAS Number:
82558-97-2
Molecular Formula:
C15H18N2O4
Molecular Weight:
290.3144
IUPAC Name:
2,6-dimethoxy-N-(3-propan-2-yl-1,2-oxazol-5-yl)benzamide
InChI:
InChI=1S/C15H18N2O4/c1-9(2)10-8-13(21-17-10)16-15(18)14-11(19-3)6-5-7-12(14)20-4/h5-9H,1-4H3,(H,16,18)
InChI Key:
BLJGYEWSMMJOEI-UHFFFAOYSA-N
SMILES:
COc1cccc(c1C(=O)Nc1onc(c1)C(C)C)OC
Properties
Complexity:
339
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.127g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
290.319g/mol
Monoisotopic Mass:
290.127g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
73.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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