3-(azepan-1-ylsulfonyl)-N-(3-nitrophenyl)benzamide


Chemical Name: 3-(azepan-1-ylsulfonyl)-N-(3-nitrophenyl)benzamide
CAS Number: 330461-64-8
Product Number: AG00CJG6(AGN-PC-0K3XTI)
Synonyms:
MDL No:
Molecular Formula: C19H21N3O5S
Molecular Weight: 403.4521

Identification/Properties


Computed Properties
Molecular Weight:
403.453g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
4
Exact Mass:
403.12g/mol
Monoisotopic Mass:
403.12g/mol
Topological Polar Surface Area:
121A^2
Heavy Atom Count:
28
Formal Charge:
0
Complexity:
650
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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