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116-34-7 | Benzenesulfonamide, 2-amino-N-ethyl-5-nitro-N-phenyl-
CAS No: 116-34-7 Catalog No: AG000BCT MDL No:MFCD00035894
Product Description
Catalog Number:
AG000BCT
Chemical Name:
Benzenesulfonamide, 2-amino-N-ethyl-5-nitro-N-phenyl-
CAS Number:
116-34-7
Molecular Formula:
C14H15N3O4S
Molecular Weight:
321.3516
MDL Number:
MFCD00035894
IUPAC Name:
2-amino-N-ethyl-5-nitro-N-phenylbenzenesulfonamide
InChI:
InChI=1S/C14H15N3O4S/c1-2-16(11-6-4-3-5-7-11)22(20,21)14-10-12(17(18)19)8-9-13(14)15/h3-10H,2,15H2,1H3
InChI Key:
AGSWRZMLPKYDNM-UHFFFAOYSA-N
SMILES:
CCN(S(=O)(=O)c1cc(ccc1N)[N+](=O)[O-])c1ccccc1
EC Number:
204-136-3
Properties
Complexity:
479
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.078g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
321.351g/mol
Monoisotopic Mass:
321.078g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
118A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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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