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Tirofiban

CAT: 1568-C09101-02Size: 25 mgDry Ice: YesHazardous: No
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CAT#:1568-C09101-02Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
144494-65-5
Synonyms
MK-383
SKU
C09101-5mg
Target
Integrin
Applications
Cytoskeletal Signaling
Smiles
CCCCS (=O) (=O) NC (CC1=CC=C (C=C1) OCCCCC2CCNCC2) C (=O) O
Molecular Formula
C22H36N2O5S
Additionnal Information
Tirofiban (MK-383) is a selective platelet GPIIb/IIIa antagonist which inhibits platelet aggregation with IC50 of 9 nM.
Storage Conditions
2 years -80 in solvent

Chemical Information

Tirofiban

Tirofiban is a member of the class of piperidines that is L-tyrosine in which a hydrogen attached to the amino group is replaced by a butylsulfonyl group and in which the hydrogen attached to the phenolic hydroxy group is replaced by a 4-(piperidin-4-yl)butyl group. It has a role as a fibrin modulating drug, an anticoagulant and a platelet glycoprotein-IIb/IIIa receptor antagonist. It is a member of piperidines, a L-tyrosine derivative and a sulfonamide.

CAS Number144494-65-5
PubChem CID60947
IUPAC Name(2S)-2-(butylsulfonylamino)-3-[4-(4-piperidin-4-ylbutoxy)phenyl]propanoic acid
Molecular FormulaC22H36N2O5S
Molecular Weight440.6
XLogP1.4
Topological Polar Surface Area113
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count14
Heavy Atom Count30
Formal Charge0
Complexity579
SMILES
CCCCS(=O)(=O)N[C@@H](CC1=CC=C(C=C1)OCCCCC2CCNCC2)C(=O)O
InChI
InChI=1S/C22H36N2O5S/c1-2-3-16-30(27,28)24-21(22(25)26)17-19-7-9-20(10-8-19)29-15-5-4-6-18-11-13-23-14-12-18/h7-10,18,21,23-24H,2-6,11-17H2,1H3,(H,25,26)/t21-/m0/s1
InChIKey
COKMIXFXJJXBQG-NRFANRHFSA-N
Chemical Structure
2D Structure
2D structure of Tirofiban
CAS: 144494-65-5
CID: 60947
Formula: C22H36N2O5S
MW: 440.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight440.6
XLogP31.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count14
Exact Mass440.23449343
Monoisotopic Mass440.23449343
Topological Polar Surface Area113 Ų
Heavy Atom Count30
Formal Charge0
Complexity579
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

Alternative Products

CatalogName
FT142225-01Tirofiban
RM-T180699-01Tirofiban Impurity 99; Tirofiban Impurity W
HY-17369ATirofiban (hydrochloride)
RM-T180600-01Tirofiban Hcl
RM-T180627-01(R) -Tirofiban
sc-208440Tirofiban, Hydrochloride

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