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NZ-28

CAT: 0013-GTR19211194-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19211194-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
NZ28 (NSC134754) is a potent and selective HSF1 inhibitor. It downregulates the expression of MICA/B on tumor cells by inhibiting HSF1, SP1, and NF-κB, and it plays a critical role in HER2-driven oncogenesis. This small molecule is a valuable research tool for studying heat shock response, tumor immunology, and oncogenic signaling in vitro.
CAS Number
75041-32-6
Smiles
C (C=1C[C@]2 (C=3C (=CC (OC) =C (OC) C3) CCN2CC1CC) [H]) [C@@H]4C=5C (CCN4) =CC=CC5
Molecular Formula
C27H34N2O2
Molecular Weight
418.57
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

(11bS)-3-ethyl-9,10-dimethoxy-2-[[(1R)-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl]-4,6,7,11b-tetrahydro-1H-benzo[a]quinolizine
CAS Number75041-32-6
PubChem CID6713547
IUPAC Name(11bS)-3-ethyl-9,10-dimethoxy-2-[[(1R)-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl]-4,6,7,11b-tetrahydro-1H-benzo[a]quinolizine
Molecular FormulaC27H34N2O2
Molecular Weight418.6
XLogP3.8
Topological Polar Surface Area33.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count31
Formal Charge0
Complexity649
SMILES
CCC1=C(C[C@H]2C3=CC(=C(C=C3CCN2C1)OC)OC)C[C@@H]4C5=CC=CC=C5CCN4
InChI
InChI=1S/C27H34N2O2/c1-4-18-17-29-12-10-20-15-26(30-2)27(31-3)16-23(20)25(29)14-21(18)13-24-22-8-6-5-7-19(22)9-11-28-24/h5-8,15-16,24-25,28H,4,9-14,17H2,1-3H3/t24-,25+/m1/s1
InChIKey
HDIJLRXRAJUXQB-RPBOFIJWSA-N
Chemical Structure
2D Structure
2D structure of (11bS)-3-ethyl-9,10-dimethoxy-2-[[(1R)-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl]-4,6,7,11b-tetrahydro-1H-benzo[a]quinolizine
CAS: 75041-32-6
CID: 6713547
Formula: C27H34N2O2
MW: 418.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight418.6
XLogP33.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass418.262028332
Monoisotopic Mass418.262028332
Topological Polar Surface Area33.7 Ų
Heavy Atom Count31
Formal Charge0
Complexity649
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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