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Home > Nitro Compounds > 321706-24-5
321706-24-5 | N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitrobenzene-1-sulfonamide
CAS No: 321706-24-5 Catalog No: AG00ITIS MDL No:MFCD01259839
Product Description
Catalog Number:
AG00ITIS
Chemical Name:
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitrobenzene-1-sulfonamide
CAS Number:
321706-24-5
Molecular Formula:
C16H18N2O6S
Molecular Weight:
366.3889
MDL Number:
MFCD01259839
IUPAC Name:
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitrobenzenesulfonamide
InChI:
InChI=1S/C16H18N2O6S/c1-23-15-8-3-12(11-16(15)24-2)9-10-17-25(21,22)14-6-4-13(5-7-14)18(19)20/h3-8,11,17H,9-10H2,1-2H3
InChI Key:
OFZQFKSYLRCFCJ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1OC)CCNS(=O)(=O)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
522
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
366.089g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
366.388g/mol
Monoisotopic Mass:
366.089g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
119A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Literature
| Title | Journal |
|---|---|
| Design, synthesis and antimalarial activity of benzene and isoquinoline sulfonamide derivatives. | Bioorganic & medicinal chemistry letters 20080115 |
| 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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