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XL44

CAT: 0931-T87644-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T87644-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2637949-91-6
Target
Apoptosis
Related Pathways
Apoptosis
Bioactivity
XL44, as an hRpn13 binder, triggers hRpn13-dependent apoptosis and limits cell viability via a PCLAF-dependent mechanism. It causes ubiquitin-dependent degradation of hRpn13 Pru and ubiquitin-independent degradation of specific KEN box-containing proteins [1].
Smiles
C(=C1C=2C(NC1=O)=CC=C(F)C2)C3=CC(NC(=O)C4=CC=C(OC)C=C4)=CC=C3
Molecular Formula
C23H17FN2O3
Molecular Weight
388.39
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

CID 171364506
CAS Number2637949-91-6
PubChem CID171364506
IUPAC NameN-[3-[(Z)-(5-fluoro-2-oxo-1H-indol-3-ylidene)methyl]phenyl]-4-methoxybenzamide
Molecular FormulaC23H17FN2O3
Molecular Weight388.4
XLogP3.8
Topological Polar Surface Area67.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count29
Formal Charge0
Complexity644
SMILES
COC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)/C=C\3/C4=C(C=CC(=C4)F)NC3=O
InChI
InChI=1S/C23H17FN2O3/c1-29-18-8-5-15(6-9-18)22(27)25-17-4-2-3-14(11-17)12-20-19-13-16(24)7-10-21(19)26-23(20)28/h2-13H,1H3,(H,25,27)(H,26,28)/b20-12-
InChIKey
UOTAUCCFVUPGRQ-NDENLUEZSA-N
Chemical Structure
2D Structure
2D structure of CID 171364506
CAS: 2637949-91-6
CID: 171364506
Formula: C23H17FN2O3
MW: 388.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight388.4
XLogP33.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass388.12232057
Monoisotopic Mass388.12232057
Topological Polar Surface Area67.4 Ų
Heavy Atom Count29
Formal Charge0
Complexity644
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-162393-01XL44

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