Products 79640-70-3

CAS 79640-70-3 appears in our catalog under these names: Methotrexate Impurity 8, Methotrexate a-tert-Butyl Ester, >95% (HPLC), Methotrexate α–tert–butyl ester, (S)-5-(tert-Butoxy)-4-(4-(((2,4-diaminopteridin-6-yl)methyl)(methyl)amino)benzamido)-5-oxopentanoic acid, 96.0%, 96.0%, Methotrexate α-tert-butyl ester, 97.38%. Offered by: Chemat Brand, TRC, GLPBio, Chemat, MedChemExpress. Available pack sizes: on request, 100mg, 25mg, 5mg, 10mg, 10 mg, 5 mg.

Structural formula: {0} (CAS {1})

(4S)-4-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid (CAS 79640-70-3) is a chemical compound with the molecular formula C24H30N8O5 and a molecular weight of 510.5 g/mol. IUPAC name: (4S)-4-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid. InChIKey: HTMMDBDGHQUHPW-INIZCTEOSA-N.

Identity
Molecular formulaC24H30N8O5
Molecular weight510.5 g/mol
IUPAC name(4S)-4-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid
InChIKeyHTMMDBDGHQUHPW-INIZCTEOSA-N
SMILESCC(C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)C1=CC=C(C=C1)N(C)CC2=CN=C3C(=N2)C(=NC(=N3)N)N

Computed by PubChem (NCBI)