General Information of the Compound
Compound ID
CP0066173
Compound Name
N-hydroxy-2,2-diphenylacetamide
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Synonyms
4099-51-8
A-phenyl-
AC1L6390
AC1Q5QC3
AKOS022308585
BDBM50207561
BENZENEACETAMIDE,N-HYDROXY-A-PHENYL-
CHEMBL396097
CTK8I6435
DTXSID10286297
Diphenylacetohydroxamic acid
Diphenylacetohydroxamic acid, &gt
MFCD16314231
N-Hydroxy diphenylacetamide
N-Hydroxydiphenylacetamide
N-hydroxy-2,2-diphenylacetamide
NSC-44620
NSC44620
SCHEMBL2839032
ZINC4522248
benzeneacetamide, n-hydroxy-
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Structure
Formula
C14H13NO2
Molecular Weight
227.263
Canonical SMILES
ONC(=O)C(c1ccccc1)c1ccccc1
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InChI
InChI=1S/C14H13NO2/c16-14(15-17)13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13,17H,(H,15,16)
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InChIKey
OFSBBVCLWMCGNY-UHFFFAOYSA-N
CAS
4099-51-8
Physicochemical Property
logP
2.3239
Rotatable Bonds
3
Heavy Atom Count
17
Polar Areas
49.33
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Complexity
17

"RO5" indicates the cutoff set by lipinski's rule of five:

(1) Molecular weight less than 500 Dalton;

(2) xlogp less than 5;

(3) No more than 5 hbonddonor (Hydrogen Bond Donor Count);

(4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count);

(5) No more than 10 rotbonds (Rotatable Bond Count).

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PubChem ID
CID: 239512
ChEMBL ID
CHEMBL396097
Map of Molecular Bioactivity Related to the Compound
Map of Molecular Bioactivity Related to the Compound

Compound
Cell Line
Protein

Bioactivity Value:

<= 0.1 μM
> 0.1 μM and <= 10 μM
> 10 μM
Imprecise Activity
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT00994, Histone deacetylase 4
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000081 Jurkat E6.1 Homo sapiens (Human)  2
1
IC50 = 2900 nM
   TI
   LI
   LO
   TS
2
IC50 > 50000 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 220 nM
2 IC50 = 250 nM
Clinical Information about the Compound
Drug 1 ( N-hydroxy-2,2-diphenylacetamide )
Drug Name N-hydroxy-2,2-diphenylacetamide
Target(s)
Histone deacetylase 4 (HDAC4)
Inhibitor