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82558-52-9 | Benzamide, N-[5-(1-ethylcyclohexyl)-3-isoxazolyl]-2,6-dimethoxy-
CAS No: 82558-52-9 Catalog No: AG004UGG MDL No:
Product Description
Catalog Number:
AG004UGG
Chemical Name:
Benzamide, N-[5-(1-ethylcyclohexyl)-3-isoxazolyl]-2,6-dimethoxy-
CAS Number:
82558-52-9
Molecular Formula:
C20H26N2O4
Molecular Weight:
358.4314
IUPAC Name:
N-[5-(1-ethylcyclohexyl)-1,2-oxazol-3-yl]-2,6-dimethoxybenzamide
InChI:
InChI=1S/C20H26N2O4/c1-4-20(11-6-5-7-12-20)16-13-17(22-26-16)21-19(23)18-14(24-2)9-8-10-15(18)25-3/h8-10,13H,4-7,11-12H2,1-3H3,(H,21,22,23)
InChI Key:
KXFBNQKWIRQDEX-UHFFFAOYSA-N
SMILES:
CCC1(CCCCC1)c1onc(c1)NC(=O)c1c(OC)cccc1OC
Properties
Complexity:
455
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
358.189g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
358.438g/mol
Monoisotopic Mass:
358.189g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
73.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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