Products for Research Use Only
RegisterLogin

ART812

CAT: 0013-GTR19188588-02Size: 5 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19188588-02Size:5 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
ART812 is a potent, orally bioavailable small molecule inhibitor of DNA polymerase theta (Polθ), with an enzymatic IC50 of 7.6 nM and a cellular MMEJ inhibition IC50 of 240 nM. This inhibitor is a valuable research tool for studying DNA repair pathways, particularly in the context of cancer research, where Polθ is a promising therapeutic target.
CAS Number
2607138-82-7
Product Name Alternative
DNASynthesis, DNA polymerase θ, DNA Synthesis, ART812, ART-812, ART 812, RNA Synthesis, RNASynthesis
Field of Research
Cell Biology, Molecular Biology
Purity
99.07% (May vary between batches)
Solubility
10% DMSO+40% PEG300+5% Tween 80+45% Saline:3.3 mg/mL (7.15 mM) ; DMSO:90 mg/mL (194.89 mM)
Smiles
CN (C (=O) [C@@H]1[C@H] (O) [C@H] (O) C (=O) N1c1cc (cc (C) n1) C (F) (F) F) c1ccc (F) c (Cl) c1
Molecular Formula
C19H16ClF4N3O4
Molecular Weight
461.79
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

(2S,3S,4S)-N-(3-Chloro-4-fluorophenyl)-3,4-dihydroxy-N-methyl-1-(6-methyl-4-(trifluoromethyl)pyridin-2-yl)-5-oxopyrrolidine-2-carboxamide
CAS Number2607138-82-7
PubChem CID156077039
IUPAC Name(2S,3S,4S)-N-(3-chloro-4-fluorophenyl)-3,4-dihydroxy-N-methyl-1-[6-methyl-4-(trifluoromethyl)-2-pyridinyl]-5-oxopyrrolidine-2-carboxamide
Molecular FormulaC19H16ClF4N3O4
Molecular Weight461.8
XLogP2.8
Topological Polar Surface Area94
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count3
Heavy Atom Count31
Formal Charge0
Complexity700
SMILES
CC1=CC(=CC(=N1)N2[C@@H]([C@@H]([C@@H](C2=O)O)O)C(=O)N(C)C3=CC(=C(C=C3)F)Cl)C(F)(F)F
InChI
InChI=1S/C19H16ClF4N3O4/c1-8-5-9(19(22,23)24)6-13(25-8)27-14(15(28)16(29)18(27)31)17(30)26(2)10-3-4-12(21)11(20)7-10/h3-7,14-16,28-29H,1-2H3/t14-,15-,16-/m0/s1
InChIKey
YJJOABOMFPGRED-JYJNAYRXSA-N
Chemical Structure
2D Structure
2D structure of (2S,3S,4S)-N-(3-Chloro-4-fluorophenyl)-3,4-dihydroxy-N-methyl-1-(6-methyl-4-(trifluoromethyl)pyridin-2-yl)-5-oxopyrrolidine-2-carboxamide
CAS: 2607138-82-7
CID: 156077039
Formula: C19H16ClF4N3O4
MW: 461.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight461.8
XLogP32.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count3
Exact Mass461.0765463
Monoisotopic Mass461.0765463
Topological Polar Surface Area94 Ų
Heavy Atom Count31
Formal Charge0
Complexity700
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
GTR19186427-01ART615
GTR19243013-01ART838
GTR19212708-01ARTD10/PARP10-IN-2
GTR19212709-01ARTD10/PARP10-IN-1
GTR18169829ARTS1 Antibody
GTR18007505ART10 Antibody
GTR18007517ART10 Antibody
GTR18007506ART10 Antibody
GTR18007504ART10 Antibody
GTR18156559ARTS1 Antibody

Alternative Products

CatalogName
M35191-01ART812

Popular Products