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Dacopafant

CAT: 0931-T23951-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T23951-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
125372-33-0
Target
HIV Protease, PAFR, Others
Related Pathways
Others, GPCR/G Protein, Microbiology/Virology, Proteases/Proteasome
Bioactivity
Dacopafant is an antagonist of platlet activationg factor receptor.
Smiles
C(N)(=O)C1=C2N([C@H](SC2)C=3C=CC=NC3)C=C1
Molecular Formula
C12H11N3OS
Molecular Weight
245.3
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Dacopafant

Dacopafant is a small molecule drug. The usage of the INN stem '-pafant' in the name indicates that Dacopafant is a platelet-activating factor antagonist. Dacopafant has a monoisotopic molecular weight of 245.06 Da.

CAS Number125372-33-0
PubChem CID205955
IUPAC Name(3R)-3-pyridin-3-yl-1,3-dihydropyrrolo[1,2-c][1,3]thiazole-7-carboxamide
Molecular FormulaC12H11N3OS
Molecular Weight245.30
XLogP0.5
Topological Polar Surface Area86.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count17
Formal Charge0
Complexity312
SMILES
C1C2=C(C=CN2[C@H](S1)C3=CN=CC=C3)C(=O)N
InChI
InChI=1S/C12H11N3OS/c13-11(16)9-3-5-15-10(9)7-17-12(15)8-2-1-4-14-6-8/h1-6,12H,7H2,(H2,13,16)/t12-/m1/s1
InChIKey
ARFOASMERCHFBY-GFCCVEGCSA-N
Chemical Structure
2D Structure
2D structure of Dacopafant
CAS: 125372-33-0
CID: 205955
Formula: C12H11N3OS
MW: 245.30
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight245.30
XLogP30.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass245.06228316
Monoisotopic Mass245.06228316
Topological Polar Surface Area86.2 Ų
Heavy Atom Count17
Formal Charge0
Complexity312
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
MBS5773711Dacopafant

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