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EMI48

CAT: 0013-GTR19187382-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19187382-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
EMI48 is an optimized derivative of EMI1 with superior inhibitory potency against mutant EGFR, specifically targeting triple-mutant forms. This small molecule is a valuable research tool for investigating resistant non-small cell lung cancer (NSCLC) in both cellular and animal model studies.
CAS Number
34564-13-1
Field of Research
Cardiovascular Research, Signal Transduction
Smiles
CCN (CC) c1ccc2cc (-c3nc4cc (C) ccc4o3) c (=O) oc2c1
Molecular Formula
C21H20N2O3
Molecular Weight
348.4
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

7-(Diethylamino)-3-(5-methylbenzoxazol-2-yl)-2-benzopyrone
CAS Number34564-13-1
PubChem CID15538560
IUPAC Name7-(diethylamino)-3-(5-methyl-1,3-benzoxazol-2-yl)chromen-2-one
Molecular FormulaC21H20N2O3
Molecular Weight348.4
XLogP4.6
Topological Polar Surface Area55.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count26
Formal Charge0
Complexity559
SMILES
CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C3=NC4=C(O3)C=CC(=C4)C
InChI
InChI=1S/C21H20N2O3/c1-4-23(5-2)15-8-7-14-11-16(21(24)26-19(14)12-15)20-22-17-10-13(3)6-9-18(17)25-20/h6-12H,4-5H2,1-3H3
InChIKey
PTAGJQADNFQMGR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 7-(Diethylamino)-3-(5-methylbenzoxazol-2-yl)-2-benzopyrone
CAS: 34564-13-1
CID: 15538560
Formula: C21H20N2O3
MW: 348.4
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight348.4
XLogP34.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass348.14739250
Monoisotopic Mass348.14739250
Topological Polar Surface Area55.6 Ų
Heavy Atom Count26
Formal Charge0
Complexity559
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

Alternative Products

CatalogName
BA6388-5EMI48

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