Home Halogens 3-(3,5-Dibromo-4-hydroxyphenyl)-n-(4-phenoxybenzyl)-1,2,4-oxadiazole-5-carboxamide

3-(3,5-Dibromo-4-hydroxyphenyl)-n-(4-phenoxybenzyl)-1,2,4-oxadiazole-5-carboxamide

CAS No.:
1191252-49-9
Catalog Number:
AG000P5O
Molecular Formula:
C22H15Br2N3O4
Molecular Weight:
545.1802
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
10mg
99%
1 week
United States
$140
- +
50mg
99%
1 week
United States
$279
- +
100mg
99%
1 week
United States
$404
- +
500mg
99%
1 week
United States
$1098
- +
Product Description
Catalog Number:
AG000P5O
Chemical Name:
3-(3,5-Dibromo-4-hydroxyphenyl)-n-(4-phenoxybenzyl)-1,2,4-oxadiazole-5-carboxamide
CAS Number:
1191252-49-9
Molecular Formula:
C22H15Br2N3O4
Molecular Weight:
545.1802
MDL Number:
MFCD28978033
IUPAC Name:
3-(3,5-dibromo-4-hydroxyphenyl)-N-[(4-phenoxyphenyl)methyl]-1,2,4-oxadiazole-5-carboxamide
InChI:
InChI=1S/C22H15Br2N3O4/c23-17-10-14(11-18(24)19(17)28)20-26-22(31-27-20)21(29)25-12-13-6-8-16(9-7-13)30-15-4-2-1-3-5-15/h1-11,28H,12H2,(H,25,29)
InChI Key:
DSFNLJXHXBIKDS-UHFFFAOYSA-N
SMILES:
O=C(c1onc(n1)c1cc(Br)c(c(c1)Br)O)NCc1ccc(cc1)Oc1ccccc1
UNII:
8Y3GDT6YWV
Properties
Complexity:
575  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
544.941g/mol
Formal Charge:
0
Heavy Atom Count:
31  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
545.187g/mol
Monoisotopic Mass:
542.943g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
97.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5  
Properties