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STM2457

CAT: 0607-B8750-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0607-B8750-10Size:10 mg
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CAS Number
2499663-01-1
Product Name Alternative
N-((5-(((cyclohexylmethyl)amino)methyl)-3aH-benzo[d]imidazol-2-yl)methyl)-4-oxo-4H-pyrido[1,2-a]pyrimidine-2-carboxamide
Purity
0.98
Solubility
≥10.6 mg/mL in DMSO; ≥26.8 mg/mL in EtOH; insoluble in H2O
Smiles
O=C1C=C(C(NCC2=NC(C=C(CNCC3CCCCC3)C=C4)C4=N2)=O)N=C5C=CC=CN51
Molecular Formula
C25H28N6O2
Molecular Weight
444.54
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

Stm2457

STM2457 is a secondary carboxamide resulting from the formal condensation of the carboxy group of 4-oxo-4H-pyrido[1,2-a]pyrimidine-2-carboxylic acid with the primary amino group of 1-[2-(aminomethyl)imidazo[1,2-a]pyridin-6-yl]-N-(cyclohexylmethyl)methanamine. It is a highly potent and selective first-in-class small molecule inhibitor of METTL3 (N6-adenosine-methyltransferase 70 kDa subunit) enzyme activity and exhibits anti-leukaemic activity. It has a role as an EC 2.1.1.348 (mRNA m6A methyltransferase) inhibitor, an antineoplastic agent and an apoptosis inducer. It is a secondary carboxamide, a pyridopyrimidine, an imidazopyridine and a secondary amino compound.

CAS Number2499663-01-1
PubChem CID155167581
IUPAC NameN-[[6-[(cyclohexylmethylamino)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]-4-oxopyrido[1,2-a]pyrimidine-2-carboxamide
Molecular FormulaC25H28N6O2
Molecular Weight444.5
XLogP2.7
Topological Polar Surface Area91.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Heavy Atom Count33
Formal Charge0
Complexity872
SMILES
C1CCC(CC1)CNCC2=CN3C=C(N=C3C=C2)CNC(=O)C4=CC(=O)N5C=CC=CC5=N4
InChI
InChI=1S/C25H28N6O2/c32-24-12-21(29-23-8-4-5-11-31(23)24)25(33)27-15-20-17-30-16-19(9-10-22(30)28-20)14-26-13-18-6-2-1-3-7-18/h4-5,8-12,16-18,26H,1-3,6-7,13-15H2,(H,27,33)
InChIKey
OBERVORNENYOLE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Stm2457
CAS: 2499663-01-1
CID: 155167581
Formula: C25H28N6O2
MW: 444.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight444.5
XLogP32.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Exact Mass444.22737416
Monoisotopic Mass444.22737416
Topological Polar Surface Area91.1 Ų
Heavy Atom Count33
Formal Charge0
Complexity872
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
MBS5765179STM2457
A23981-50STM2457 50mg
A23981-1STM2457 1mg
A23981-10STM2457 10mg
A23981-5STM2457 5mg

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