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ITSA-1

CAT: 0931-T3358-06Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0931-T3358-06Size:200 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
200626-61-5
Target
HDAC
Related Pathways
DNA Damage/DNA Repair, Chromatin/Epigenetic
Purity
0.9989
Bioactivity
ITSA-1 is membrane permeable and specifically suppresses TSA inhibition of HDAC (histone deacetylase), but shows no activity towards other HDAC inhibitors.
Smiles
Clc1ccc(C(=O)n2nnc3ccccc23)c(Cl)c1
Molecular Formula
C13H7Cl2N3O
Molecular Weight
292.12
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Itsa-1

1-(2,4-dichlorobenzoyl)-1H-1,2,3-benzotriazole is a member of the class of benzamides that is obtained by the formal condensation of 2,4-dichlorobenzoic acid and benzotriazole. It acts as an inhibitor for tubulin acetylation mediated by trichostatin A. It has a role as an inhibitor. It is a member of benzamides, a dichlorobenzene and a member of benzotriazoles. It is functionally related to a 2,4-dichlorobenzoic acid and a benzotriazole.

CAS Number200626-61-5
PubChem CID771910
IUPAC Namebenzotriazol-1-yl-(2,4-dichlorophenyl)methanone
Molecular FormulaC13H7Cl2N3O
Molecular Weight292.12
XLogP3.9
Topological Polar Surface Area47.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count19
Formal Charge0
Complexity355
SMILES
C1=CC=C2C(=C1)N=NN2C(=O)C3=C(C=C(C=C3)Cl)Cl
InChI
InChI=1S/C13H7Cl2N3O/c14-8-5-6-9(10(15)7-8)13(19)18-12-4-2-1-3-11(12)16-17-18/h1-7H
InChIKey
UVNLAUGZMOPBPR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Itsa-1
CAS: 200626-61-5
CID: 771910
Formula: C13H7Cl2N3O
MW: 292.12
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight292.12
XLogP33.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass290.9966172
Monoisotopic Mass290.9966172
Topological Polar Surface Area47.8 Ų
Heavy Atom Count19
Formal Charge0
Complexity355
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
MBS131384ITSA-1 (ITSA1; ITSA 1)
2089-5ITSA-1
A16127-200ITSA-1 200mg
C13344-01ITSA-1 (ITSA1)
A16127-500ITSA-1 500mg
A16127-100ITSA-1 100mg
A16127-25ITSA-1 25mg
A16127-10ITSA-1 10mg
A16127-5ITSA-1 5mg
HY-100508RITSA-1 (Standard)

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