Products for Research Use Only
RegisterLogin

SR121566A

CAT: 0931-T12999-02Size: 50 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-T12999-02Size:50 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
180144-61-0
Target
Others, Integrin
Related Pathways
Others, Cytoskeletal Signaling
Bioactivity
SR121566A is a novel non-peptide antagonist of Glycoprotein IIb/IIIa (GP IIb-IIIa) .
Smiles
O=C(O)CN1CCC(N(C2=NC(=CS2)C=3C=CC(=CC3)C(=N)N)CCC(=O)O)CC1
Molecular Formula
C20H25N5O4S
Molecular Weight
431.51
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

3-[[4-(4-Carbamimidoylphenyl)-1,3-thiazol-2-yl]-[1-(carboxymethyl)piperidin-4-yl]amino]propanoic acid
CAS Number180144-61-0
PubChem CID9867414
IUPAC Name3-[[4-(4-carbamimidoylphenyl)-1,3-thiazol-2-yl]-[1-(carboxymethyl)piperidin-4-yl]amino]propanoic acid
Molecular FormulaC20H25N5O4S
Molecular Weight431.5
XLogP-0.6
Topological Polar Surface Area172
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count9
Heavy Atom Count30
Formal Charge0
Complexity620
SMILES
C1CN(CCC1N(CCC(=O)O)C2=NC(=CS2)C3=CC=C(C=C3)C(=N)N)CC(=O)O
InChI
InChI=1S/C20H25N5O4S/c21-19(22)14-3-1-13(2-4-14)16-12-30-20(23-16)25(10-7-17(26)27)15-5-8-24(9-6-15)11-18(28)29/h1-4,12,15H,5-11H2,(H3,21,22)(H,26,27)(H,28,29)
InChIKey
LYIQNVKSTSEEEG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-[[4-(4-Carbamimidoylphenyl)-1,3-thiazol-2-yl]-[1-(carboxymethyl)piperidin-4-yl]amino]propanoic acid
CAS: 180144-61-0
CID: 9867414
Formula: C20H25N5O4S
MW: 431.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight431.5
XLogP3-0.6
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count9
Exact Mass431.16272547
Monoisotopic Mass431.16272547
Topological Polar Surface Area172 Ų
Heavy Atom Count30
Formal Charge0
Complexity620
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
FHA14461SR121566A

Popular Products