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(S) -Thalidomide

CAT: 1410-M33094-01Size: 1 EachDry Ice: NoHazardous: No
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Description
(S) -Thalidomide ((S) - (-) -Thalidomide) is the S-isomer of Thalidomide with immunomodulatory, anti-inflammatory, anticancer, anti-angiogenic, and pro-apoptotic activities, used in studying leprosy erythema nodosum and myeloma.
CAS Number
841-67-8
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
258.23
Molecular Formula
C13H10N2O4
Notes
Research use only, not for human use.
Receptor
Apoptosis

Chemical Information

(S)-Thalidomide

(S)-thalidomide is a 2-(2,6-dioxopiperidin-3-yl)-1H-isoindole-1,3(2H)-dione that has S-configuration at the chiral centre. It has a role as a teratogenic agent. It is an enantiomer of a (R)-thalidomide.

CAS Number841-67-8
PubChem CID92142
IUPAC Name2-[(3S)-2,6-dioxopiperidin-3-yl]isoindole-1,3-dione
Molecular FormulaC13H10N2O4
Molecular Weight258.23
XLogP0.3
Topological Polar Surface Area83.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count19
Formal Charge0
Complexity449
SMILES
C1CC(=O)NC(=O)[C@H]1N2C(=O)C3=CC=CC=C3C2=O
InChI
InChI=1S/C13H10N2O4/c16-10-6-5-9(11(17)14-10)15-12(18)7-3-1-2-4-8(7)13(15)19/h1-4,9H,5-6H2,(H,14,16,17)/t9-/m0/s1
InChIKey
UEJJHQNACJXSKW-VIFPVBQESA-N
Chemical Structure
2D Structure
2D structure of (S)-Thalidomide
CAS: 841-67-8
CID: 92142
Formula: C13H10N2O4
MW: 258.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight258.23
XLogP30.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass258.06405680
Monoisotopic Mass258.06405680
Topological Polar Surface Area83.6 Ų
Heavy Atom Count19
Formal Charge0
Complexity449
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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