CAS 685847-78-3

4-[bis(2-chloroethyl)nitroryl]-L-phenylalanine

Description:

4-[Bis(2-chloroethyl)nitroryl]-L-phenylalanine, identified by its CAS number 685847-78-3, is a synthetic compound that belongs to the class of amino acid derivatives. This substance features a phenylalanine backbone, which is an essential amino acid known for its role in protein synthesis and as a precursor to neurotransmitters. The presence of bis(2-chloroethyl) groups indicates that this compound may possess alkylating properties, which can be significant in medicinal chemistry, particularly in the development of anticancer agents. The nitroryl functional group suggests potential reactivity and biological activity, possibly influencing the compound's mechanism of action. In terms of solubility, such compounds often exhibit varying degrees of solubility in polar and non-polar solvents, which can affect their bioavailability and pharmacokinetics. Overall, the unique structural features of 4-[bis(2-chloroethyl)nitroryl]-L-phenylalanine may contribute to its potential applications in therapeutic contexts, although specific biological activities and safety profiles would require further investigation through empirical studies.

Formula: C₁₃H₁₈Cl₂N₂O₃

InChI: InChI=1/C13H18Cl2N2O3/c14-5-7-17(20,8-6-15)11-3-1-10(2-4-11)9-12(16)13(18)19/h1-4,12H,5-9,16H2,(H,18,19)/t12-/m0/s1

SMILES: c1cc(ccc1C[C@@H](C(=O)O)N)N(=O)(CCCl)CCCl

Synonyms:

• Melphalan N-Oxide
• L-Phenylalanine, 4-[bis(2-chloroethyl)oxidoamino]-
• PX478
• Melphalan Impurity 26
• DISCONTINUED
• GSKQMLGAUOTSKT-LBPRGKRZSA-N
• Melphalan Impurity 16 HCl
• 4-[Bis(2-chloroethyl)oxidoamino]-L-phenylalanine
• 4-[Bis(2-chloroethyl)oxidoaMino]-

Melphalan Impurity 16 HCl

CAS: 685847-78-3

Formula: C₁₃H₁₈Cl₂N₂O₃·HCl

Color and Shape: Off-White Solid

Molecular weight: 321.21 36.46

Ref: 4Z-M-8531