Melphalan Hydrochloride
(2S)-2-amino-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid;hydrochloride
Molecular Identity
Melphalan Hydrochloride
(2S)-2-amino-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid;hydrochloride
PubChem CID: 9927978
2D Structure
Properties
C13H19Cl3N2O2
Molecular Formula
341.70
Molecular Weight
g/mol
340.0512
Exact Mass
Da
66.6
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
4
H-Bond Acceptors
265
Complexity
SMILES
Canonical SMILES
SMILES: C1=CC(=CC=C1CC(C(=O)O)N)N(CCCl)CCCl.ClIsomeric SMILES
SMILES: C1=CC(=CC=C1C[C@@H](C(=O)O)N)N(CCCl)CCCl.ClSynonyms(20)
Melphalan hydrochloride3223-07-2Melphalan HClAlkeran hydrochlorideCB 3025 hydrochlorideEvomelaPhenylalanine mustard hydrochlorideL-Sarcolysine hydrochlorideSarcolysin hydrochloride, l-1VXP4V453TMelfalan hydrochlorideCB-3025 HYDROCHLORIDEALANINE, 3-(p-(BIS(2-CHLOROETHYL)AMINO)PHENYL)-, MONOHYDROCHLORIDE, L-L-Phenylalanine mustard hydrochlorideUNII-1VXP4V453T
Data from PubChem (NCBI)
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