HF-2159 hydrochloride structure

HF-2159 hydrochloride

8-chloro-6-(4-methylpiperazin-1-ium-1-yl)benzo[b][1,4]benzothiazepine chloride

CAS: 4956-31-4
Molecular Formula C18H19Cl2N3S
Molecular Weight 380.3 g/mol
Topological Polar Surface Area 45.3 A2
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 4
Rotatable Bonds 1
Exact Mass 379.0677
Heavy Atoms 24
Complexity 450.0

Chemical Identifiers

CAS Number 4956-31-4
SMILES CN1CC[NH+](CC1)C2=NC3=CC=CC=C3SC4=C2C=C(C=C4)Cl.[Cl-]
InChIKey HBBGEMOWBPOXIL-UHFFFAOYSA-N

📖 Product Overview

HF-2159 hydrochloride (CAS: 4956-31-4) is a chemical compound with molecular formula C18H19Cl2N3S and molecular weight 380.3 g/mol. Its IUPAC systematic name is 8-chloro-6-(4-methylpiperazin-1-ium-1-yl)benzo[b][1,4]benzothiazepine chloride. Topological Polar Surface Area 45.3 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 1 Exact Mass 379.0677 Heavy Atoms 24 Complexity 450.0 InChI Key: HBBGEMOWBPOXIL-UHFFFAOYSA-N. SMILES: CN1CC[NH+](CC1)C2=NC3=CC=CC=C3SC4=C2C=C(C=C4)Cl.[Cl-].

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
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