Avoralstat

InvivoChem Cat #:V4837CAS #:918407-35-9Purity >=98%

Description: Avoralstat (formerly also known as BCX-4161) is a novel, potent and orally bioavailable inhibitor of Kallikrein and Bradykinin with the potential for treatment for Hereditary angioedema. Avoralstat inhibits plasma kallikrein and suppresses bradykinin production.

References: J Allergy Clin Immunol. 2016 Sep; 138(3):934-936.e5.

-20C for 3 years in powder form

Synonym: BCX-4161; BCX 4161; BCX4161
IUPAC/Chemical Name: 3-{2-[(4-carbamimidoylphenyl)carbamoyl]-4-ethenyl-5-methoxyphenyl}-6-[(cyclopropylmethyl)carbamoyl]pyridine-2-carboxylic acid
InChi Key: TUWMKPVJGGWGNL-UHFFFAOYSA-N
InChi Code: InChI=1S/C28H27N5O5/c1-3-16-12-21(26(34)32-18-8-6-17(7-9-18)25(29)30)20(13-23(16)38-2)19-10-11-22(33-24(19)28(36)37)27(35)31-14-15-4-5-15/h3, 6-13, 15H, 1, 4-5, 14H2, 2H3, (H3, 29, 30)(H, 31, 35)(H, 32, 34)(H, 36, 37)
SMILES Code: O=C(C1=NC(C(NCC2CC2)=O)=CC=C1C3=CC(OC)=C(C=C)C=C3C(NC4=CC=C(C(N)=N)C=C4)=O)O