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Chemical structure of TCV-309 chloride

GC33088

TCV-309 chloride

Also known as 2-[3-(N-(5-bromo-1-propylpyridin-1-ium-3-carbonyl)anilino)propanoylamino]ethyl 3,4-dihydro-1H-isoquinoline-2-carboxylate chloride

TCV-309 chloride is a potent and specific platelet activating factor (PAF) antagonist· TCV-309 chloride specifically inhibits PAF-induced aggregation of rabbit and human platelets, and [3H]PAF binding to rabbit platelet microsomes with IC50 values of 33 nM, 58 nM and 27 nM, respectively· TCV-309 chloride has beneficial effects in anaphylactic shock

ChemicalCAS121494-09-5MW629.97FormulaC30H34BrClN4O4
CAS number
121494-09-5
Molecular weight
629.97
Formula
C30H34BrClN4O4
Solubility
DMSO : ≥ 6·3 mg/mL (10·00 mM)
InChIKey
HBWMSZWQSYEBPL-UHFFFAOYSA-N
Catalogue number
GC33088
Brand
GLPBIO
Computed properties PubChem CID 15037614 · TPSA 82.8 Ų · H-bond donors 1 · H-bond acceptors 5
TPSA
82.8 Ų
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
11
Heavy atoms
40

SMILES CCC[N+]1=CC(=CC(=C1)Br)C(=O)N(CCC(=O)NCCOC(=O)N2CCC3=CC=CC=C3C2)C4=CC=CC=C4.[Cl-]

Computed descriptors from PubChem (CID 15037614), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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