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704875-75-2 | 2,4-dimethyl-3-(1H-tetrazol-1-yl)benzenesulfonamide
CAS No: 704875-75-2 Catalog No: AG00JH58 MDL No:MFCD05857993
Product Description
Catalog Number:
AG00JH58
Chemical Name:
2,4-dimethyl-3-(1H-tetrazol-1-yl)benzenesulfonamide
CAS Number:
704875-75-2
Molecular Formula:
C9H11N5O2S
Molecular Weight:
253.2809
MDL Number:
MFCD05857993
IUPAC Name:
2,4-dimethyl-3-(tetrazol-1-yl)benzenesulfonamide
InChI:
InChI=1S/C9H11N5O2S/c1-6-3-4-8(17(10,15)16)7(2)9(6)14-5-11-12-13-14/h3-5H,1-2H3,(H2,10,15,16)
InChI Key:
ZGEJQVRYHPUISD-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1n1cnnn1)C)S(=O)(=O)N
Properties
Complexity:
368
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.063g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
253.28g/mol
Monoisotopic Mass:
253.063g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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