BRN 5673592

3-[(4-phenylpiperazin-1-yl)methyl]-5-[(2-propylquinazolin-4-yl)oxymethyl]-1,3,4-oxadiazole-2-thione

CAS: 96547-00-1

Molecular Formula	`C25H28N6O2S`
Molecular Weight	476.6 g/mol
LogP	5.1
Topological Polar Surface Area	98.4 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	8
Rotatable Bonds	8
Exact Mass	476.19943
Heavy Atoms	34
Complexity	710.0

Chemical Identifiers

CAS Number	96547-00-1
SMILES	`CCCC1=NC2=CC=CC=C2C(=N1)OCC3=NN(C(=S)O3)CN4CCN(CC4)C5=CC=CC=C5`
InChIKey	`XSNATBMYNDMDCW-UHFFFAOYSA-N`

📖 Product Overview

BRN 5673592 (CAS: 96547-00-1) is a chemical compound with molecular formula C25H28N6O2S and molecular weight 476.6 g/mol. Its IUPAC systematic name is 3-[(4-phenylpiperazin-1-yl)methyl]-5-[(2-propylquinazolin-4-yl)oxymethyl]-1,3,4-oxadiazole-2-thione. LogP 5.1 Topological Polar Surface Area 98.4 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 8 Rotatable Bonds 8 Exact Mass 476.19943 Heavy Atoms 34 Complexity 710.0 InChI Key: XSNATBMYNDMDCW-UHFFFAOYSA-N. SMILES: CCCC1=NC2=CC=CC=C2C(=N1)OCC3=NN(C(=S)O3)CN4CCN(CC4)C5=CC=CC=C5.

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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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