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906-43-4 | Benzenesulfonamide, 4-[(3,5-dimethyl-1H-pyrazol-4-yl)azo]-N-phenyl-
CAS No: 906-43-4 Catalog No: AG006BTX MDL No:
Product Description
Catalog Number:
AG006BTX
Chemical Name:
Benzenesulfonamide, 4-[(3,5-dimethyl-1H-pyrazol-4-yl)azo]-N-phenyl-
CAS Number:
906-43-4
Molecular Formula:
C17H17N5O2S
Molecular Weight:
355.4142
IUPAC Name:
4-[(3,5-dimethyl-1H-pyrazol-4-yl)diazenyl]-N-phenylbenzenesulfonamide
InChI:
InChI=1S/C17H17N5O2S/c1-12-17(13(2)19-18-12)21-20-14-8-10-16(11-9-14)25(23,24)22-15-6-4-3-5-7-15/h3-11,22H,1-2H3,(H,18,19)
InChI Key:
PDWYZUPCANYKCV-UHFFFAOYSA-N
SMILES:
Cc1[nH]nc(c1N=Nc1ccc(cc1)S(=O)(=O)Nc1ccccc1)C
Properties
Complexity:
548
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
355.11g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
355.416g/mol
Monoisotopic Mass:
355.11g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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