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82558-76-7 | Benzamide, 2,6-dimethoxy-N-[3-(1-propylcyclohexyl)-5-isoxazolyl]-
CAS No: 82558-76-7 Catalog No: AG004U7D MDL No:
Product Description
Catalog Number:
AG004U7D
Chemical Name:
Benzamide, 2,6-dimethoxy-N-[3-(1-propylcyclohexyl)-5-isoxazolyl]-
CAS Number:
82558-76-7
Molecular Formula:
C21H28N2O4
Molecular Weight:
372.4580
IUPAC Name:
2,6-dimethoxy-N-[3-(1-propylcyclohexyl)-1,2-oxazol-5-yl]benzamide
InChI:
InChI=1S/C21H28N2O4/c1-4-11-21(12-6-5-7-13-21)17-14-18(27-23-17)22-20(24)19-15(25-2)9-8-10-16(19)26-3/h8-10,14H,4-7,11-13H2,1-3H3,(H,22,24)
InChI Key:
ABERSITYYAJYBG-UHFFFAOYSA-N
SMILES:
CCCC1(CCCCC1)c1noc(c1)NC(=O)c1c(OC)cccc1OC
Properties
Complexity:
469
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
372.205g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
372.465g/mol
Monoisotopic Mass:
372.205g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
73.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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