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Chemical structure of Anatibant 2HCl

GC72919

Anatibant 2HCl

Also listed as Anatibant hydrochloride

Anatibant (LF 16-0687; XY-2405) drochloride is a selective non-peptide bradykinin B2 receptor antagonist

ChemicalCAS209788-45-4MW784.58FormulaC34H38Cl4N6O5S
CAS number
209788-45-4
Molecular weight
784.58
Formula
C34H38Cl4N6O5S
Solubility
DMSO : 55 mg/mL (70·10 mM; Need ultrasonic and warming)
InChIKey
CTFZQFRXSBZMTH-LPCSYZHESA-N
Catalogue number
GC72919
Brand
GLPBIO
Computed properties PubChem CID 21968582 · TPSA 176 Ų · H-bond donors 6 · H-bond acceptors 8
TPSA
176 Ų
H-bond donors
6
H-bond acceptors
8
Rotatable bonds
12
Heavy atoms
50

SMILES CC1=CC(=NC2=C1C=CC=C2OCC3=C(C=CC(=C3Cl)S(=O)(=O)N4CCC[C@H]4C(=O)NCCCNC(=O)C5=CC=C(C=C5)C(=N)N)Cl)C.Cl.Cl

Computed descriptors from PubChem (CID 21968582), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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