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UC-112

CAT: 1410-M14330-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M14330-02Size:5 mg
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Description
UC-112 is a novel IAP inhibitor that potently inhibits human melanoma (A375 and M14) and human prostate (PC-3 and DU145) cancer cell lines with IC50 of 0.7-3.4 uM.
CAS Number
383392-66-3
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
348.4382
Molecular Formula
C22H24N2O2
Notes
Research use only, not for human use.
Receptor
IAP

Chemical Information

5-((Benzyloxy)methyl)-7-(pyrrolidin-1-ylmethyl)quinolin-8-ol

5-(phenylmethoxymethyl)-7-(1-pyrrolidinylmethyl)-8-quinolinol is a hydroxyquinoline.

CAS Number383392-66-3
PubChem CID3426979
IUPAC Name5-(phenylmethoxymethyl)-7-(pyrrolidin-1-ylmethyl)quinolin-8-ol
Molecular FormulaC22H24N2O2
Molecular Weight348.4
XLogP3.3
Topological Polar Surface Area45.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count26
Formal Charge0
Complexity420
SMILES
C1CCN(C1)CC2=CC(=C3C=CC=NC3=C2O)COCC4=CC=CC=C4
InChI
InChI=1S/C22H24N2O2/c25-22-18(14-24-11-4-5-12-24)13-19(20-9-6-10-23-21(20)22)16-26-15-17-7-2-1-3-8-17/h1-3,6-10,13,25H,4-5,11-12,14-16H2
InChIKey
LTGLGIQQZXSLLF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-((Benzyloxy)methyl)-7-(pyrrolidin-1-ylmethyl)quinolin-8-ol
CAS: 383392-66-3
CID: 3426979
Formula: C22H24N2O2
MW: 348.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight348.4
XLogP33.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass348.183778013
Monoisotopic Mass348.183778013
Topological Polar Surface Area45.6 Ų
Heavy Atom Count26
Formal Charge0
Complexity420
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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