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Lomeguatrib

CAT: 0013-GTR19173822-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19173822-02Size:50 mg
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Description
Lomeguatrib (PaTrin-2) is a small molecule inhibitor of the DNA repair protein MGMT (O6-methylguanine-DNA methyltransferase) . It is used in research to sensitize tumor cells to alkylating agents like temozolomide, both in vitro and in vivo, for studying chemotherapeutic resistance mechanisms.
CAS Number
192441-08-0
Product Name Alternative
O6- (4-Bromothenyl) guanine
Field of Research
Epigenetics & Chromatin
Purity
>98%
Bioactivity
MGMT inhibitor
Form
Powder
Solubility
Soluble in DMSO (up to 10 mg/ml with warming)
Smiles
O (CC1=CC (Br) =CS1) C2=C3C (=NC (N) =N2) N=CN3
Molecular Formula
C10H8BrN5O3S
Molecular Weight
326.2
Storage Conditions
-20°C
Notes
For research use only.
Other Product Names
2-Amino-6-[ (4-bromo-2-thienyl) methoxy]-9H-purine

Chemical Information

Lomeguatrib

Lomeguatrib is a small molecule drug. Lomeguatrib has a monoisotopic molecular weight of 324.96 Da.

CAS Number192441-08-0
PubChem CID3025944
IUPAC Name6-[(4-bromothiophen-2-yl)methoxy]-7H-purin-2-amine
Molecular FormulaC10H8BrN5OS
Molecular Weight326.17
XLogP2
Topological Polar Surface Area118
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count18
Formal Charge0
Complexity299
SMILES
C1=C(SC=C1Br)COC2=NC(=NC3=C2NC=N3)N
InChI
InChI=1S/C10H8BrN5OS/c11-5-1-6(18-3-5)2-17-9-7-8(14-4-13-7)15-10(12)16-9/h1,3-4H,2H2,(H3,12,13,14,15,16)
InChIKey
JUJPKFNFCWJBCX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Lomeguatrib
CAS: 192441-08-0
CID: 3025944
Formula: C10H8BrN5OS
MW: 326.17
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight326.17
XLogP32
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass324.96329
Monoisotopic Mass324.96329
Topological Polar Surface Area118 Ų
Heavy Atom Count18
Formal Charge0
Complexity299
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

Alternative Products

CatalogName
A1912-50Lomeguatrib

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