Name: XZ739
Rating: 5 (10 reviews)

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结构编辑

类似物检索

HIT ID:HIT214323360
Cas No:2365172-19-4
常用名:XZ739
别名:XZ739
IUPAC:4-(4-{[2-(4-chlorophenyl)-5,5-dimethylcyclohex-1-en-1-yl]methyl}piperazin-1-yl)-N-{4-[(2R)-16-{[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxo-2,3-dihydro-1H-isoindol-4-yl]amino}-5-methyl-2-[(phenylsulfanyl)methyl]-8,11,14-trioxa-1,5-diazahexadecan-1-yl]-3-trifluoromethanesulfonylbenzenesulfonyl}benzamide
IUPAC:4-(4-{[2-(4-chlorophenyl)-5,5-dimethylcyclohex-1-en-1-yl]methyl}piperazin-1-yl)-N-{4-[(2R)-16-{[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxo-2,3-dihydro-1H-isoindol-4-yl]amino}-5-methyl-2-[(phenylsulfanyl)methyl]-8,11,14-trioxa-1,5-diazahexadecan-1-yl]-3-trifluoromethanesulfonylbenzenesulfonyl}benzamide
InChI key:RTASGZOITGGVPZ-YJUSKGKKSA-N

分子式:C65H76ClF3N8O12S3
分子量:1349.99
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CN(CCOCCOCCOCCNc1cccc2C(=O)N(C3CCC(=O)NC3=O)C(=O)c12)CC[C@H](CSc1ccccc1)Nc1ccc(cc1S(=O)(=O)C(F)(F)F)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(CC2=C(CCC(C)(C)C2)c2ccc(Cl)cc2)CC1 |t:81|
SMILES:CN(CCOCCOCCOCCNc1cccc2C(=O)N(C3CCC(=O)NC3=O)C(=O)c12)CC[C@H](CSc1ccccc1)Nc1ccc(cc1S(=O)(=O)C(F)(F)F)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(CC2=C(CCC(C)(C)C2)c2ccc(Cl)cc2)CC1 |t:81|

XZ739 is a Cereblon-dependent PROTAC BCL-XL degrader, targeting a member of the Bcl-2 family, with a DC50 value of 2.5 nM in MOLT-4 cells after 16 hours of treatment. Additionally, XZ739 elicits cell death via caspase-mediated apoptosis.

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