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82558-66-5 | Benzamide, 2,6-dimethoxy-N-[3-(1-methylcyclohexyl)-5-isoxazolyl]-
CAS No: 82558-66-5 Catalog No: AG00572V MDL No:
Product Description
Catalog Number:
AG00572V
Chemical Name:
Benzamide, 2,6-dimethoxy-N-[3-(1-methylcyclohexyl)-5-isoxazolyl]-
CAS Number:
82558-66-5
Molecular Formula:
C19H24N2O4
Molecular Weight:
344.4049
IUPAC Name:
2,6-dimethoxy-N-[3-(1-methylcyclohexyl)-1,2-oxazol-5-yl]benzamide
InChI:
InChI=1S/C19H24N2O4/c1-19(10-5-4-6-11-19)15-12-16(25-21-15)20-18(22)17-13(23-2)8-7-9-14(17)24-3/h7-9,12H,4-6,10-11H2,1-3H3,(H,20,22)
InChI Key:
QDWFOWXCNOQUJG-UHFFFAOYSA-N
SMILES:
COc1cccc(c1C(=O)Nc1onc(c1)C1(C)CCCCC1)OC
Properties
Complexity:
441
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.174g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
344.411g/mol
Monoisotopic Mass:
344.174g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
73.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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