72695-23-9 Purity
95%
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Specification
The molecular formula is C15H15N3O3.
Some synonyms include Bortezomib acid methyl ester, 4HLP399ZJY, and UNII-4HLP399ZJY.
The molecular weight is 285.30 g/mol.
It was created on February 8, 2007.
The IUPAC name is methyl (2S)-3-phenyl-2-(pyrazine-2-carbonylamino)propanoate.
The InChI is InChI=1S/C15H15N3O3/c1-21-15(20)12(9-11-5-3-2-4-6-11)18-14(19)13-10-16-7-8-17-13/h2-8,10,12H,9H2,1H3,(H,18,19)/t12-/m0/s1.
The InChIKey is AGZXSMPTQAISJW-LBPRGKRZSA-N.
The canonical SMILES is COC(=O)C(CC1=CC=CC=C1)NC(=O)C2=NC=CN=C2.
The CAS number is 73058-37-4.
The XLogP3 value is 0.8.