Products for Research Use Only
RegisterLogin

CM39

CAT: 0013-GTR19211490-01Size: 25 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19211490-01Size:25 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
CM39 is a small molecule inhibitor of aldehyde dehydrogenase (ALDH) . As ALDH activity, particularly of the ALDH1A isoforms, is a key marker for cancer stem-like cells and chemoresistance, this compound is a valuable research tool for investigating these mechanisms in both in vitro and in vivo oncology models.
CAS Number
361156-54-9
Field of Research
Metabolism Research
Smiles
S (CC1=CC (F) =CC=C1) C=2N (C (=O) C3=C (N2) NN=C3) C4=C (C) C=CC=C4
Molecular Formula
C19H15FN4OS
Molecular Weight
366.41
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

6-[(3-fluorophenyl)methylsulfanyl]-5-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-one
CAS Number361156-54-9
PubChem CID3248741
IUPAC Name6-[(3-fluorophenyl)methylsulfanyl]-5-(2-methylphenyl)-1H-pyrazolo[5,4-d]pyrimidin-4-one
Molecular FormulaC19H15FN4OS
Molecular Weight366.4
XLogP4
Topological Polar Surface Area86.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count26
Formal Charge0
Complexity560
SMILES
CC1=CC=CC=C1N2C(=O)C3=C(NN=C3)N=C2SCC4=CC(=CC=C4)F
InChI
InChI=1S/C19H15FN4OS/c1-12-5-2-3-8-16(12)24-18(25)15-10-21-23-17(15)22-19(24)26-11-13-6-4-7-14(20)9-13/h2-10H,11H2,1H3,(H,21,23)
InChIKey
SSEVBNPAVKLWFQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 6-[(3-fluorophenyl)methylsulfanyl]-5-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-one
CAS: 361156-54-9
CID: 3248741
Formula: C19H15FN4OS
MW: 366.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight366.4
XLogP34
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass366.09506045
Monoisotopic Mass366.09506045
Topological Polar Surface Area86.7 Ų
Heavy Atom Count26
Formal Charge0
Complexity560
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

Related Products

CatalogName
GTR19186676-01CM398
GTR17949603CM3 Antibody
GTR18989803-01Plant Triticum aestivum Alpha-amylase/trypsin inhibitor CM3 Protein
GTR18989867-01Plant Triticum aestivum Alpha-amylase/trypsin inhibitor CM3 Protein

Alternative Products

CatalogName
T69366-01CM39

Popular Products