Home Halogens 1H-Pyrazole-5-carboxamide, 4-chloro-N-[[4-(1,1-dimethylethyl)phenyl]methyl]-3-ethyl-1-methyl-

1H-Pyrazole-5-carboxamide, 4-chloro-N-[[4-(1,1-dimethylethyl)phenyl]methyl]-3-ethyl-1-methyl-

CAS No.:
119168-77-3
Catalog Number:
AG000I9R
Molecular Formula:
C18H24ClN3O
Molecular Weight:
333.8557
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25mg
98%(GC)
In Stock USA
United States
$73
- +
100mg
98%(GC)
In Stock USA
United States
$142
- +
1g
98%(GC)
In Stock USA
United States
$686
- +
Product Description
Catalog Number:
AG000I9R
Chemical Name:
1H-Pyrazole-5-carboxamide, 4-chloro-N-[[4-(1,1-dimethylethyl)phenyl]methyl]-3-ethyl-1-methyl-
CAS Number:
119168-77-3
Molecular Formula:
C18H24ClN3O
Molecular Weight:
333.8557
MDL Number:
MFCD01632408
IUPAC Name:
N-[(4-tert-butylphenyl)methyl]-4-chloro-5-ethyl-2-methylpyrazole-3-carboxamide
InChI:
InChI=1S/C18H24ClN3O/c1-6-14-15(19)16(22(5)21-14)17(23)20-11-12-7-9-13(10-8-12)18(2,3)4/h7-10H,6,11H2,1-5H3,(H,20,23)
InChI Key:
ZZYSLNWGKKDOML-UHFFFAOYSA-N
SMILES:
CCc1nn(c(c1Cl)C(=O)NCc1ccc(cc1)C(C)(C)C)C
EC Number:
601-585-0
UNII:
IRU3P7ZB3F
Properties
Complexity:
402  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
333.161g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
333.86g/mol
Monoisotopic Mass:
333.161g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
46.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5  
Literature
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