Products 1040526-12-2

CAS 1040526-12-2 appears in our catalog under these names: Lp533401 hydrochloride, 95%, LP-533401 HCl, 97%, LP-533401 hydrochloride/ 98%, LP533401 hcl, LP-533401 hydrochloride. Offered by: Combi-blocks, AmBeed, TargetMol, GLPBio, Biosynth. Available pack sizes: 100mg, 1mg, 5mg, 10mg, 25mg, 10mM (in 1ml dmso), 50mg, 10mM/1mL.

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

(2S)-2-amino-3-[4-[2-amino-6-[2,2,2-trifluoro-1-[4-(3-fluorophenyl)phenyl]ethoxy]pyrimidin-4-yl]phenyl]propanoic acid;hydrochloride (CAS 1040526-12-2) is a chemical compound with the molecular formula C27H23ClF4N4O3 and a molecular weight of 562.9 g/mol. IUPAC name: (2S)-2-amino-3-[4-[2-amino-6-[2,2,2-trifluoro-1-[4-(3-fluorophenyl)phenyl]ethoxy]pyrimidin-4-yl]phenyl]propanoic acid;hydrochloride. InChIKey: BHBWZCUMIXCDPM-CHXZROHQSA-N.

Identity
Molecular formulaC27H23ClF4N4O3
Molecular weight562.9 g/mol
IUPAC name(2S)-2-amino-3-[4-[2-amino-6-[2,2,2-trifluoro-1-[4-(3-fluorophenyl)phenyl]ethoxy]pyrimidin-4-yl]phenyl]propanoic acid;hydrochloride
InChIKeyBHBWZCUMIXCDPM-CHXZROHQSA-N
SMILESC1=CC(=CC(=C1)F)C2=CC=C(C=C2)C(C(F)(F)F)OC3=NC(=NC(=C3)C4=CC=C(C=C4)C[C@@H](C(=O)O)N)N.Cl

Computed by PubChem (NCBI)