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NCT-58

CAT: 1410-M29016-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M29016-02Size:5 mg
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Description
NCT-58 is a potent C-terminal HSP90 inhibitor. NCT-58 does not induce the heat shock response (HSR) .
CAS Number
2411429-33-7
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
466.57
Molecular Formula
C27H34N2O5
Notes
Research use only, not for human use.
Receptor
HSP

Chemical Information

5-Methoxy-N-[3-methoxy-4-[2-(2-piperidinyl)ethoxy]phenyl]-2,2-dimethyl-2H-1-benzopyran-6-carboxamide
CAS Number2411429-33-7
PubChem CID149033485
IUPAC Name5-methoxy-N-[3-methoxy-4-(2-piperidin-2-ylethoxy)phenyl]-2,2-dimethylchromene-6-carboxamide
Molecular FormulaC27H34N2O5
Molecular Weight466.6
XLogP4.4
Topological Polar Surface Area78.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Heavy Atom Count34
Formal Charge0
Complexity699
SMILES
CC1(C=CC2=C(O1)C=CC(=C2OC)C(=O)NC3=CC(=C(C=C3)OCCC4CCCCN4)OC)C
InChI
InChI=1S/C27H34N2O5/c1-27(2)14-12-20-22(34-27)11-9-21(25(20)32-4)26(30)29-19-8-10-23(24(17-19)31-3)33-16-13-18-7-5-6-15-28-18/h8-12,14,17-18,28H,5-7,13,15-16H2,1-4H3,(H,29,30)
InChIKey
QGEKYFVMAGLOKW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-Methoxy-N-[3-methoxy-4-[2-(2-piperidinyl)ethoxy]phenyl]-2,2-dimethyl-2H-1-benzopyran-6-carboxamide
CAS: 2411429-33-7
CID: 149033485
Formula: C27H34N2O5
MW: 466.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight466.6
XLogP34.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Exact Mass466.24677219
Monoisotopic Mass466.24677219
Topological Polar Surface Area78.1 Ų
Heavy Atom Count34
Formal Charge0
Complexity699
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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