Products for Research Use Only

PRLX-93936 HCL

CAT: 0931-T36404L-01Size: 1 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-T36404L-01Size:1 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
1094210-96-4
Target
Ferroptosis, Reactive Oxygen Species, Ras, HIF/HIF Prolyl-Hydroxylase
Related Pathways
NF-κB, Immunology/Inflammation, GPCR/G Protein, Chromatin/Epigenetic, MAPK, Metabolism, Apoptosis
Purity
>99.99%
Bioactivity
PRLX-93936 HCL is an analog of erastin and demonstrated synergistic effects against non-small cell lung cancer (NSCLC) cells with cisplatin.
Smiles
Cl.Cl.CCOc1ccccc1-n1c(CN2CCNCC2)nc2ccccc2c1=O
Molecular Formula
C21H26Cl2N4O2
Molecular Weight
437.37
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Prlx-93936 hcl
CAS Number1094210-96-4
PubChem CID169553399
IUPAC Name3-(2-ethoxyphenyl)-2-(piperazin-1-ylmethyl)quinazolin-4-one;dihydrochloride
Molecular FormulaC21H26Cl2N4O2
Molecular Weight437.4
Topological Polar Surface Area57.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count29
Formal Charge0
Complexity546
SMILES
CCOC1=CC=CC=C1N2C(=NC3=CC=CC=C3C2=O)CN4CCNCC4.Cl.Cl
InChI
InChI=1S/C21H24N4O2.2ClH/c1-2-27-19-10-6-5-9-18(19)25-20(15-24-13-11-22-12-14-24)23-17-8-4-3-7-16(17)21(25)26;;/h3-10,22H,2,11-15H2,1H3;2*1H
InChIKey
XAJQBNZNMGZZTL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Prlx-93936 hcl
CAS: 1094210-96-4
CID: 169553399
Formula: C21H26Cl2N4O2
MW: 437.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight437.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass436.1432815
Monoisotopic Mass436.1432815
Topological Polar Surface Area57.2 Ų
Heavy Atom Count29
Formal Charge0
Complexity546
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes