Xevinapant (AT406)

Xevinapant (AT406, ARRY-334543, Debio1143, SM-406) is a potent Smac mimetic and an antagonist of IAP (inhibitor of apoptosis protein via E3 ubiquitin ligase), binding to XIAP-BIR3, cIAP1-BIR3 and cIAP2-BIR3 with Ki of 66.4 nM, 1.9 nM, and 5.1 nM, 50- to 100-fold higher affinities than the Smac AVPI peptide. Phase 1.

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Trivial name	ARRY-334543, Debio1143, SM-406
Catalog Number	S2754
Molecular Formula	C32H43N5O4
CAS#	1071992-99-8
Inchi	InChI=1S/C32H43N5O4/c1-21(2)19-28(38)36-18-17-25-15-16-27(37(25)32(41)26(20-36)34-30(39)22(3)33-4)31(40)35-29(23-11-7-5-8-12-23)24-13-9-6-10-14-24/h5-14,21-22,25-27,29,33H,15-20H2,1-4H3,(H,34,39)(H,35 ,40)/t22-,25+,26-,27-/m0/s1
Inchi Key	LSXUTRRVVSPWDZ-MKKUMYSQSA-N
SMILES	CC(C)CC(=O)N1CCC2CCC(N2C(=O)C(C1)NC(=O)C(C)NC)C(=O)NC(C3=CC=CC=C3)C4=CC=CC=C4
Size	10mM/1mL
Supplier Page	http://www.selleckchem.com/products/at-406.html
Additional Information	https://file.selleck.cn/downloads/struct/AT-406-chemical-structure-s2754.gif