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89757-64-2 | Butanamide, 4-chloro-N-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-
CAS No: 89757-64-2 Catalog No: AG0040AU MDL No:
Product Description
Catalog Number:
AG0040AU
Chemical Name:
Butanamide, 4-chloro-N-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-
CAS Number:
89757-64-2
Molecular Formula:
C13H14ClN3O3
Molecular Weight:
295.7216
IUPAC Name:
4-chloro-N-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]butanamide
InChI:
InChI=1S/C13H14ClN3O3/c1-19-10-6-4-9(5-7-10)12-16-17-13(20-12)15-11(18)3-2-8-14/h4-7H,2-3,8H2,1H3,(H,15,17,18)
InChI Key:
DNEZLJYAUVNOQS-UHFFFAOYSA-N
SMILES:
ClCCCC(=O)Nc1nnc(o1)c1ccc(cc1)OC
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.072g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
295.723g/mol
Monoisotopic Mass:
295.072g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
77.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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