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Chemical structure of Methotrexate

GC10405

Methotrexate

Also known as (2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]pentanedioic acid

Methotrexate is an antifolate antimetabolite that effectively inhibits the activity of dihydrofolate reductase (DHFR), with an IC50 of approximately 7nM

ChemicalCAS59-05-2MW454.44FormulaC20H22N8O5
CAS number
59-05-2
Molecular weight
454.44
Formula
C20H22N8O5
Solubility
≥ 21·55 mg/mL in DMSO
InChIKey
FBOZXECLQNJBKD-ZDUSSCGKSA-N
Catalogue number
GC10405
Brand
GLPBIO
Computed properties PubChem CID 126941 · XLogP -1.8 · TPSA 211 Ų · H-bond donors 5
XLogP
-1.8
TPSA
211 Ų
H-bond donors
5
H-bond acceptors
12
Rotatable bonds
9
Heavy atoms
33

SMILES CN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)O)C(=O)O

Computed descriptors from PubChem (CID 126941), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Pricing
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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Universities, hospitals and biotech companies across Israel. Research use only — not for diagnostic or therapeutic use.