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Home Sulfos Benzenesulfonamide, 4-chloro-N-[2-(4-morpholinyl)ethyl]-3-nitro-

Benzenesulfonamide, 4-chloro-N-[2-(4-morpholinyl)ethyl]-3-nitro-

CAS No.:
743452-14-4
Catalog Number:
AG005C28
Molecular Formula:
C12H16ClN3O5S
Molecular Weight:
349.7905
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Product Description
Catalog Number:
AG005C28
Chemical Name:
Benzenesulfonamide, 4-chloro-N-[2-(4-morpholinyl)ethyl]-3-nitro-
CAS Number:
743452-14-4
Molecular Formula:
C12H16ClN3O5S
Molecular Weight:
349.7905
MDL Number:
MFCD01269351
IUPAC Name:
4-chloro-N-(2-morpholin-4-ylethyl)-3-nitrobenzenesulfonamide
InChI:
InChI=1S/C12H16ClN3O5S/c13-11-2-1-10(9-12(11)16(17)18)22(19,20)14-3-4-15-5-7-21-8-6-15/h1-2,9,14H,3-8H2
InChI Key:
IUHPWOOFODCLOQ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1Cl)S(=O)(=O)NCCN1CCOCC1
Properties
Complexity:
472  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
349.05g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
349.786g/mol
Monoisotopic Mass:
349.05g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
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
Properties