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651768-06-8

651768-06-8 | Octanediamide, N-phenyl-N'-2-pyridinyl-

CAS No: 651768-06-8 Catalog No: AG00H7QK MDL No:

Product Description

Catalog Number:
AG00H7QK
Chemical Name:
Octanediamide, N-phenyl-N'-2-pyridinyl-
CAS Number:
651768-06-8
Molecular Formula:
C19H23N3O2
Molecular Weight:
325.4048
IUPAC Name:
N-phenyl-N'-pyridin-2-yloctanediamide
InChI:
InChI=1S/C19H23N3O2/c23-18(21-16-10-4-3-5-11-16)13-6-1-2-7-14-19(24)22-17-12-8-9-15-20-17/h3-5,8-12,15H,1-2,6-7,13-14H2,(H,21,23)(H,20,22,24)
InChI Key:
QSUXHQUVCUHWJP-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccccc1)CCCCCCC(=O)Nc1ccccn1

Properties

Complexity:
381  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.179g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
325.412g/mol
Monoisotopic Mass:
325.179g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
71.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

Literature

Title Journal
Histone deacetylase inhibitors reverse gene silencing in Friedreich's ataxia. Nature chemical biology 20061001
Novel histone deacetylase inhibitors: design, synthesis, enzyme inhibition, and binding mode study of SAHA-based non-hydroxamates. Bioorganic & medicinal chemistry letters 20031215

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