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Home Sulfos N-Butyl 4-(4-bromopyrazol-1-yl)benzenesulfonamide

N-Butyl 4-(4-bromopyrazol-1-yl)benzenesulfonamide

CAS No.:
1199773-41-5
Catalog Number:
AG000PYF
Molecular Formula:
C13H16BrN3O2S
Molecular Weight:
358.2540
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG000PYF
Chemical Name:
N-Butyl 4-(4-bromopyrazol-1-yl)benzenesulfonamide
CAS Number:
1199773-41-5
Molecular Formula:
C13H16BrN3O2S
Molecular Weight:
358.2540
MDL Number:
MFCD13195728
IUPAC Name:
4-(4-bromopyrazol-1-yl)-N-butylbenzenesulfonamide
InChI:
InChI=1S/C13H16BrN3O2S/c1-2-3-8-16-20(18,19)13-6-4-12(5-7-13)17-10-11(14)9-15-17/h4-7,9-10,16H,2-3,8H2,1H3
InChI Key:
QYGWYBRUHYBDBA-UHFFFAOYSA-N
SMILES:
CCCCNS(=O)(=O)c1ccc(cc1)n1ncc(c1)Br
Properties
Complexity:
391  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
357.015g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
358.254g/mol
Monoisotopic Mass:
357.015g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
72.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties