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DRB18

CAT: 0931-T22317-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-T22317-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2863686-81-9
Target
Transporter
Related Pathways
Metabolism
Purity
0.9954
Bioactivity
DRB18 is a highly effective pan-class inhibitor of glucose transporter proteins (GLUT) . It significantly modulates energy-related metabolism in A549 cells by inducing alterations in the abundance of metabolites associated with glucose-related pathways. DRB18 exerts its effects by promoting G1/S phase arrest, increasing oxidative stress, and prompting necrotic cell death, ultimately displaying notable anti-tumor activity [1].
Smiles
CC1=C(C=C(C=C1)CNC2=C(C=C(C=C2)Cl)NCC3=CC(=C(C=C3)C)O)O
Molecular Formula
C22H23ClN2O2
Molecular Weight
382.88
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

5,5'-(((4-Chloro-1,2-phenylene)bis(azanediyl))bis(methylene))bis(2-methylphenol)
CAS Number2863686-81-9
PubChem CID154824629
IUPAC Name5-[[4-chloro-2-[(3-hydroxy-4-methylphenyl)methylamino]anilino]methyl]-2-methylphenol
Molecular FormulaC22H23ClN2O2
Molecular Weight382.9
XLogP5.5
Topological Polar Surface Area64.5
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count27
Formal Charge0
Complexity452
SMILES
CC1=C(C=C(C=C1)CNC2=C(C=C(C=C2)Cl)NCC3=CC(=C(C=C3)C)O)O
InChI
InChI=1S/C22H23ClN2O2/c1-14-3-5-16(9-21(14)26)12-24-19-8-7-18(23)11-20(19)25-13-17-6-4-15(2)22(27)10-17/h3-11,24-27H,12-13H2,1-2H3
InChIKey
WNTAQMQIZGJASL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5,5'-(((4-Chloro-1,2-phenylene)bis(azanediyl))bis(methylene))bis(2-methylphenol)
CAS: 2863686-81-9
CID: 154824629
Formula: C22H23ClN2O2
MW: 382.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight382.9
XLogP35.5
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass382.1448057
Monoisotopic Mass382.1448057
Topological Polar Surface Area64.5 Ų
Heavy Atom Count27
Formal Charge0
Complexity452
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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CatalogName
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