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82559-76-0 | Benzamide, N-(3-hexyl-5-isoxazolyl)-2,6-dimethoxy-
CAS No: 82559-76-0 Catalog No: AG00572H MDL No:
Product Description
Catalog Number:
AG00572H
Chemical Name:
Benzamide, N-(3-hexyl-5-isoxazolyl)-2,6-dimethoxy-
CAS Number:
82559-76-0
Molecular Formula:
C18H24N2O4
Molecular Weight:
332.3942
IUPAC Name:
N-(3-hexyl-1,2-oxazol-5-yl)-2,6-dimethoxybenzamide
InChI:
InChI=1S/C18H24N2O4/c1-4-5-6-7-9-13-12-16(24-20-13)19-18(21)17-14(22-2)10-8-11-15(17)23-3/h8,10-12H,4-7,9H2,1-3H3,(H,19,21)
InChI Key:
WIEGTZZXCHSOCM-UHFFFAOYSA-N
SMILES:
CCCCCCc1noc(c1)NC(=O)c1c(OC)cccc1OC
Properties
Complexity:
368
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
332.174g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
332.4g/mol
Monoisotopic Mass:
332.174g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
73.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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