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(Rac) -Telmesteine

CAT: 0931-T12678-01Size: 1 gDry Ice: NoHazardous: No
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CAT#:0931-T12678-01Size:1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
127657-29-8
Target
Protease, Others, Serine Protease
Related Pathways
Proteases/Proteasome, Others
Purity
0.9991
Bioactivity
(Rac) -Telmesteine (3,4-Thiazolidinedicarboxylic Acid 3-Ethyl Ester) is an inhibitor of protease and is thus a suitable enzyme stabilizer.
Smiles
CCOC(=O)N1CSCC1C(O)=O
Molecular Formula
C7H11NO4S
Molecular Weight
205.23
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

3-(Ethoxycarbonyl)-1,3-thiazolidine-4-carboxylic acid
CAS Number127657-29-8
PubChem CID11615393
IUPAC Name3-ethoxycarbonyl-1,3-thiazolidine-4-carboxylic acid
Molecular FormulaC7H11NO4S
Molecular Weight205.23
XLogP0.6
Topological Polar Surface Area92.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count13
Formal Charge0
Complexity221
SMILES
CCOC(=O)N1CSCC1C(=O)O
InChI
InChI=1S/C7H11NO4S/c1-2-12-7(11)8-4-13-3-5(8)6(9)10/h5H,2-4H2,1H3,(H,9,10)
InChIKey
XBJWOGLKABXFJE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-(Ethoxycarbonyl)-1,3-thiazolidine-4-carboxylic acid
CAS: 127657-29-8
CID: 11615393
Formula: C7H11NO4S
MW: 205.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight205.23
XLogP30.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass205.04087901
Monoisotopic Mass205.04087901
Topological Polar Surface Area92.1 Ų
Heavy Atom Count13
Formal Charge0
Complexity221
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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