BRN 1049922

6-bromo-3-[[5-(4-methoxyanilino)-1,3,4-oxadiazol-2-yl]methyl]-2-methylquinazolin-4-one

CAS: 40889-66-5

Molecular Formula	`C19H16BrN5O3`
Molecular Weight	442.3 g/mol
LogP	2.8
Topological Polar Surface Area	92.9 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	5
Exact Mass	441.04364
Heavy Atoms	28
Complexity	598.0

Chemical Identifiers

CAS Number	40889-66-5
SMILES	`CC1=NC2=C(C=C(C=C2)Br)C(=O)N1CC3=NN=C(O3)NC4=CC=C(C=C4)OC`
InChIKey	`ZTMWVEKMTWIHPX-UHFFFAOYSA-N`

📖 Product Overview

BRN 1049922 (CAS: 40889-66-5) is a chemical compound with molecular formula C19H16BrN5O3 and molecular weight 442.3 g/mol. Its IUPAC systematic name is 6-bromo-3-[[5-(4-methoxyanilino)-1,3,4-oxadiazol-2-yl]methyl]-2-methylquinazolin-4-one. LogP 2.8 Topological Polar Surface Area 92.9 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 7 Rotatable Bonds 5 Exact Mass 441.04364 Heavy Atoms 28 Complexity 598.0 InChI Key: ZTMWVEKMTWIHPX-UHFFFAOYSA-N. SMILES: CC1=NC2=C(C=C(C=C2)Br)C(=O)N1CC3=NN=C(O3)NC4=CC=C(C=C4)OC.

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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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