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SEW84

CAT: 0013-GTR19210447-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19210447-01Size:25 mg
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Description
SEW84 is a potent inhibitor of Aha1-stimulated Hsp90 ATPase activity, demonstrating an IC50 of 0.3 μM. This compound is a valuable research tool for studying protein misfolding diseases, such as Alzheimer's and Huntington's, in both in vitro and cellular model systems.
CAS Number
259089-67-3
Field of Research
Metabolism Research, Signal Transduction
Smiles
C (NNC (NC1=CC (C (F) (F) F) =CC=C1) =S) (=O) C=2N (C=CC2) C3=CC=C (F) C=C3
Molecular Formula
C19H14F4N4OS
Molecular Weight
422.4
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

1-[[1-(4-Fluorophenyl)pyrrole-2-carbonyl]amino]-3-[3-(trifluoromethyl)phenyl]thiourea
CAS Number259089-67-3
PubChem CID2740977
IUPAC Name1-[[1-(4-fluorophenyl)pyrrole-2-carbonyl]amino]-3-[3-(trifluoromethyl)phenyl]thiourea
Molecular FormulaC19H14F4N4OS
Molecular Weight422.4
XLogP4.4
Topological Polar Surface Area90.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count29
Formal Charge0
Complexity583
SMILES
C1=CC(=CC(=C1)NC(=S)NNC(=O)C2=CC=CN2C3=CC=C(C=C3)F)C(F)(F)F
InChI
InChI=1S/C19H14F4N4OS/c20-13-6-8-15(9-7-13)27-10-2-5-16(27)17(28)25-26-18(29)24-14-4-1-3-12(11-14)19(21,22)23/h1-11H,(H,25,28)(H2,24,26,29)
InChIKey
QEJONNSHVNSZBJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-[[1-(4-Fluorophenyl)pyrrole-2-carbonyl]amino]-3-[3-(trifluoromethyl)phenyl]thiourea
CAS: 259089-67-3
CID: 2740977
Formula: C19H14F4N4OS
MW: 422.4
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight422.4
XLogP34.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass422.08244490
Monoisotopic Mass422.08244490
Topological Polar Surface Area90.2 Ų
Heavy Atom Count29
Formal Charge0
Complexity583
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
463598SEW84

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