Sal003

CAT: 1410-M17162-07Size: 100 mgDry Ice: NoHazardous: No

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CAT#:1410-M17162-07Size:100 mg

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Description

Sal003, an effective cell-permeable analog, inhibitis the eIF2α phosphatase.

CAS Number

1164470-53-4

Stability

≥ 2 years

Purity

>98% (HPLC)

Weight

463.21

Molecular Formula

C18H15Cl4N3OS

Notes

Research use only, not for human use.

Receptor

EIF-2α phosphatase

Chemical Information

(2E)-3-phenyl-N-(2,2,2-trichloro-1-(((4-chlorophenyl)carbamothioyl)amino)ethyl)prop-2-enamide, (2E)-3-phenyl-N-(2,2,2-trichloro-1-((

CAS Number	1164470-53-4
PubChem CID	5717737
IUPAC Name	(E)-3-phenyl-N-[2,2,2-trichloro-1-[(4-chlorophenyl)carbamothioylamino]ethyl]prop-2-enamide
Molecular Formula	C18H15Cl4N3OS
Molecular Weight	463.2
XLogP	5.6
Topological Polar Surface Area	85.3
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	5
Heavy Atom Count	27
Formal Charge	0
Complexity	527

SMILES

C1=CC=C(C=C1)/C=C/C(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H15Cl4N3OS/c19-13-7-9-14(10-8-13)23-17(27)25-16(18(20,21)22)24-15(26)11-6-12-4-2-1-3-5-12/h1-11,16H,(H,24,26)(H2,23,25,27)/b11-6+

InChIKey

TVNBASWNLOIQML-IZZDOVSWSA-N

Chemical Structure

2D Structure

CAS: 1164470-53-4

CID: 5717737

Formula: C18H15Cl4N3OS

MW: 463.2

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	463.2
XLogP3	5.6
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	5
Exact Mass	462.966044
Monoisotopic Mass	460.968994
Topological Polar Surface Area	85.3 Å²
Heavy Atom Count	27
Formal Charge	0
Complexity	527
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes