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Ipfencarbazone

CAS No.:
212201-70-2
Catalog Number:
AG00BF3V
Molecular Formula:
C18H14Cl2F2N4O2
Molecular Weight:
427.2322
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
10mg
99%
1 week
United States
$232
- +
50mg
99%
1 week
United States
$557
- +
Product Description
Catalog Number:
AG00BF3V
Chemical Name:
Ipfencarbazone
CAS Number:
212201-70-2
Molecular Formula:
C18H14Cl2F2N4O2
Molecular Weight:
427.2322
MDL Number:
MFCD28124386
IUPAC Name:
1-(2,4-dichlorophenyl)-N-(2,4-difluorophenyl)-5-oxo-N-propan-2-yl-1,2,4-triazole-4-carboxamide
InChI:
InChI=1S/C18H14Cl2F2N4O2/c1-10(2)25(16-6-4-12(21)8-14(16)22)17(27)24-9-23-26(18(24)28)15-5-3-11(19)7-13(15)20/h3-10H,1-2H3
InChI Key:
DHYXNIKICPUXJI-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)F)N(C(=O)n1cnn(c1=O)c1ccc(cc1Cl)Cl)C(C)C
UNII:
UQ14O0CKS1
Properties
Complexity:
639  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
426.046g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
427.233g/mol
Monoisotopic Mass:
426.046g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7  
Properties