Products for Research Use Only
RegisterLogin

CAY10444

CAT: 1568-C01513-01Size: 5 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:1568-C01513-01Size:5 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
298186-80-8
Synonyms
BML-241
SKU
C01513-5mg
Target
S1P Receptor
Applications
GPCR & G Protein
Smiles
CCCCCCCCCCCC1NC (CS1) C (O) =O
Additionnal Information
CAY10444 (BML-241) is a sphingosine-1-phosphate 3 (S1P3) antagonist, which can inhibit S1P response of S1P3 cell line with 78% inhibition rate and IC50 of 4.6 μM.
Storage Conditions
3 years -20°C powder

Chemical Information

(4R)-2-undecyl-1,3-thiazolidine-4-carboxylic acid

4-thiazolidinecarboxylic acid, 2-undecyl-, (4r)- is a L-alpha-amino acid.

CAS Number298186-80-8
PubChem CID2727678
IUPAC Name(4R)-2-undecyl-1,3-thiazolidine-4-carboxylic acid
Molecular FormulaC15H29NO2S
Molecular Weight287.5
XLogP3.3
Topological Polar Surface Area74.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count11
Heavy Atom Count19
Formal Charge0
Complexity248
SMILES
CCCCCCCCCCCC1N[C@@H](CS1)C(=O)O
InChI
InChI=1S/C15H29NO2S/c1-2-3-4-5-6-7-8-9-10-11-14-16-13(12-19-14)15(17)18/h13-14,16H,2-12H2,1H3,(H,17,18)/t13-,14?/m0/s1
InChIKey
FNBSOIBCKUUVJJ-LSLKUGRBSA-N
Chemical Structure
2D Structure
2D structure of (4R)-2-undecyl-1,3-thiazolidine-4-carboxylic acid
CAS: 298186-80-8
CID: 2727678
Formula: C15H29NO2S
MW: 287.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight287.5
XLogP33.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count11
Exact Mass287.19190034
Monoisotopic Mass287.19190034
Topological Polar Surface Area74.6 Ų
Heavy Atom Count19
Formal Charge0
Complexity248
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
C07035-5mgCAY10465
C07035-25mgCAY10465
C03568-5mgCAY10499
C07035-01CAY10465
C03568CAY10499
C07493-5mgBML-210 (CAY10433)
C07493-01BML-210 (CAY10433)
C07493-25mgBML-210 (CAY10433)
C07493-100mgBML-210 (CAY10433)
C07493-1gBML-210 (CAY10433)

Alternative Products

CatalogName
E1158-5mgCAY10444

Popular Products