Ipsapirone hydrochloride

1,1-dioxo-2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-1,2-benzothiazol-3-one;hydrochloride

CAS: 92589-98-5

Molecular Formula	`C19H24ClN5O3S`
Molecular Weight	437.9 g/mol
Topological Polar Surface Area	95.1 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	6
Exact Mass	437.12885
Heavy Atoms	29
Complexity	638.0

Chemical Identifiers

CAS Number	92589-98-5
SMILES	`C1CN(CCN1CCCCN2C(=O)C3=CC=CC=C3S2(=O)=O)C4=NC=CC=N4.Cl`
InChIKey	`USDUGJXCPKBJTN-UHFFFAOYSA-N`

📖 Product Overview

Ipsapirone hydrochloride (CAS: 92589-98-5) is a chemical compound with molecular formula C19H24ClN5O3S and molecular weight 437.9 g/mol. Its IUPAC systematic name is 1,1-dioxo-2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-1,2-benzothiazol-3-one;hydrochloride. Topological Polar Surface Area 95.1 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 7 Rotatable Bonds 6 Exact Mass 437.12885 Heavy Atoms 29 Complexity 638.0 InChI Key: USDUGJXCPKBJTN-UHFFFAOYSA-N. SMILES: C1CN(CCN1CCCCN2C(=O)C3=CC=CC=C3S2(=O)=O)C4=NC=CC=N4.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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We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.

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