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STF-118804

CAT: 0013-GTR19160196-02Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19160196-02Size:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
STF-118804 is a potent and highly specific NAMPT inhibitor (nicotinamide phosphoribosyl transferase inhibitor), which improves survival in an orthotopic xenotransplant model of high-risk acute lymphoblastic leukemia, and targets leukemia stem cells.
CAS Number
894187-61-2
Product Name Alternative
STF118804 | STF 118804
Purity
>98% (HPLC)
Solubility
DMSO : ≥ 31 mg/mL; 67.17 mM
Smiles
Cc1ccc (cc1) S (=O) (=O) Cc1c (oc (n1) c1ccc (cc1) C (=O) NCc1cnccc1) C
Molecular Formula
C25H23N3O4S
Molecular Weight
461.53
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.
Other Product Names
4- (5-methyl-4- (tosylmethyl) oxazol-2-yl) -N- (pyridin-3-ylmethyl) benzamide

Chemical Information

4-(5-Methyl-4-(tosylmethyl)oxazol-2-yl)-N-(pyridin-3-ylmethyl)benzamide
CAS Number894187-61-2
PubChem CID20916937
IUPAC Name4-[5-methyl-4-[(4-methylphenyl)sulfonylmethyl]-1,3-oxazol-2-yl]-N-(pyridin-3-ylmethyl)benzamide
Molecular FormulaC25H23N3O4S
Molecular Weight461.5
XLogP3.2
Topological Polar Surface Area111
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Heavy Atom Count33
Formal Charge0
Complexity739
SMILES
CC1=CC=C(C=C1)S(=O)(=O)CC2=C(OC(=N2)C3=CC=C(C=C3)C(=O)NCC4=CN=CC=C4)C
InChI
InChI=1S/C25H23N3O4S/c1-17-5-11-22(12-6-17)33(30,31)16-23-18(2)32-25(28-23)21-9-7-20(8-10-21)24(29)27-15-19-4-3-13-26-14-19/h3-14H,15-16H2,1-2H3,(H,27,29)
InChIKey
DLFCEZOMHBPDGI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-(5-Methyl-4-(tosylmethyl)oxazol-2-yl)-N-(pyridin-3-ylmethyl)benzamide
CAS: 894187-61-2
CID: 20916937
Formula: C25H23N3O4S
MW: 461.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight461.5
XLogP33.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Exact Mass461.14092740
Monoisotopic Mass461.14092740
Topological Polar Surface Area111 Ų
Heavy Atom Count33
Formal Charge0
Complexity739
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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