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82205-97-8 | Benzenesulfonamide,N-4-pyrimidinyl-
CAS No: 82205-97-8 Catalog No: AG008LFN MDL No:
Product Description
Catalog Number:
AG008LFN
Chemical Name:
Benzenesulfonamide,N-4-pyrimidinyl-
CAS Number:
82205-97-8
Molecular Formula:
C10H9N3O2S
Molecular Weight:
235.2624
IUPAC Name:
N-pyrimidin-4-ylbenzenesulfonamide
InChI:
InChI=1S/C10H9N3O2S/c14-16(15,9-4-2-1-3-5-9)13-10-6-7-11-8-12-10/h1-8H,(H,11,12,13)
InChI Key:
KPWVGGNPTKQPST-UHFFFAOYSA-N
SMILES:
O=S(=O)(c1ccccc1)Nc1ccncn1
Properties
Complexity:
307
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.042g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
235.261g/mol
Monoisotopic Mass:
235.042g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
80.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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