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Tenovin-6

Tenovin-6 structure

CAS No:
1011557-82-6
Formula:
C25H34N4O2S
Chemical Name:
Tenovin-6
Synonyms:
Tenovin-6;N-[[[4-[[5-(Dimethylamino)-1-oxopentyl]amino]phenyl]amino]thioxomethyl]-4-(1,1-dimethylethyl)benzamide;Benzamide, N-[[[4-[[5-(dimethylamino)-1-oxopentyl]amino]phenyl]amino]thioxomethyl]-4-(1,1-dimethylethyl)-;N-[[[4-[[5-(Dimethylamino)-1-oxopentyl]amino]phenyl]amino]thioxomethyl]-4-(1,1-dimethylethyl)benzamideTenovin-6;Tenovin-6, >=98%;4-(tert-Butyl)-N-((4-(4-(dimethylamino)butanamido)phenyl)carbAmothioyl)benzamide
Categories:
Biochemical Engineering > Inhibitors

Description

Tenovin-6 is a water soluble inhibitor of SIRT1 and SIRT2, slightly inhibits HDAC8, and is also a potent activator of p53, with IC50s of 21 μM, 10 μM, and 67 μM for SirT1, SirT2, and SirT3, respectively.

Tenovin-6 is a monocarboxylic acid amide obtained by formal condensation of the carboxy group of 5-(dimethylamino)pentanoic acid with the aromatic amino group of N-[(4-aminophenyl)carbamothioyl]-4-tert-butylbenzamide. It has a role as an antineoplastic agent, a Sir2 inhibitor and a p53 activator. It is a monocarboxylic acid amide, a member of thioureas and a tertiary amino compound.

Tenovin-6 Basic Attributes

Molecular Weight：

454.62806

Exact Mass：

454.240234

DSSTox ID：

DTXSID50647242

HScode：

29242990

Characteristics

PSA：

106

XLogP3：

3.64

Density：

1.171±0.06 g/cm3(Predicted)

Refractive Index：

1.617

Drug Information

MeSH Entry Terms：

N-((4-(5-(dimethylamino)-(1-(oxopentyl)amino)phenyl)amino)thioxomethyl)-(4-(1,1-dimethylethyl)benzamide)

Computed Properties

Molecular Weight:454.6
XLogP3:5.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:9
Exact Mass:454.24024751
Monoisotopic Mass:454.24024751
Topological Polar Surface Area:106
Heavy Atom Count:32
Complexity:616
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes