ChemicalBook--->CAS DataBase List--->894187-61-2

894187-61-2

894187-61-2 Structure

894187-61-2 Structure
IdentificationBack Directory
[Name]

STF-118804
[CAS]

894187-61-2
[Synonyms]

CS-1510
STF-118804
AGN-PC-0329XY
AKOS001906141
MCULE-5035356713
AGN-PC-0329XY; AKOS001906141; MCULE-5035356713; STF-118804
STF-118804, AGN-PC-0329XY, AKOS001906141, MCULE-5035356713
4-(5-methyl-4-((phenylsulfonyl)methyl)oxazol-2-yl)-N-(pyridin-3-ylmethyl)benzamide
4-[5-Methyl-4-[[(4-methylphenyl)sulfonyl]methyl]-2-oxazolyl]-N-(3-pyridinylmethyl)benzamide
Benzamide, 4-[5-methyl-4-[[(4-methylphenyl)sulfonyl]methyl]-2-oxazolyl]-N-(3-pyridinylmethyl)-
4-[5-methyl-4-[(4-methylphenyl)sulfonylmethyl]-1,3-oxazol-2-yl]-N-(pyridin-3-ylmethyl)benzamide
[Molecular Formula]

C25H23N3O4S
[MDL Number]

MFCD14918065
[MOL File]

894187-61-2.mol
[Molecular Weight]

461.53
Chemical PropertiesBack Directory
[Melting point ]

187-190°C
[density ]

1.281±0.06 g/cm3(Predicted)
[storage temp. ]

Refrigerator
[solubility ]

DMSO (Slightly), Methanol (Slightly)
[form ]

Solid
[pka]

13.00±0.46(Predicted)
[color ]

White to Off-White
[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
[SMILES]

O=C(C1=CC=C(C2=NC(CS(=O)(C3=CC=C(C)C=C3)=O)=C(C)O2)C=C1)NCC4=CN=CC=C4
Safety DataBack Directory
[WGK Germany ]

WGK 3
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

STF-118804 is a highly specific NAMPT inhibitor, improves survival in an orthotopic xenotransplant model of high-risk acute lymphoblastic leukemia, and targets leukemia stem cells.
[Biological Activity]

STF-118804 displays pancreatic ductal adenocarcinoma (PDAC) growth reducing potential in combination with chemotherapeutic drugs.''STF-118804 is a highly specific and potent NAMPT (nicotinamide phosphoribosyl transferase) inhibitor th at reduces the viability of most B-ALL cell lines. STF 118804 induces leukemia cell apoptosis including leukemia initiating (stem) cells. STF 118804 improves survival in an orthotopic xenotransplant model of high-risk acute lymphoblastic leukemia.
[in vivo]

STF-118804 (25 mg/kg, i.p., 3 weeks) demonstrates antitumor activity in an orthotopic mouse model of PDAC (Panc-1)[1].
STF-118804 (50 mg/kg, s.c., 20 days) improves survival in an orthotopic xenotransplant mouse model of high-risk acute lymphoblastic leukemia[2].

Animal Model:Nude mice (gender not specified, age 4 - 6 weeks) inoculated with Panc-1 cells expressing GFP-luciferase to establish an orthotopic pancreatic cancer model[1]
Dosage: 25 mg/kg
Administration: Intraperitoneal injection (i.p.), 3 weeks
Result:Reduced tumor growth as demonstrated by decreased luminescence, tumor weight and size.
Had no significant toxicity.
[storage]

Store at -20°C
Spectrum DetailBack Directory
[Spectrum Detail]

STF-118804(894187-61-2)1HNMR
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