BRN 5674405

5-[(2-ethylquinazolin-4-yl)oxymethyl]-3-[[4-(4-methylphenyl)piperazin-1-yl]methyl]-1,3,4-oxadiazole-2-thione

CAS: 96546-96-2

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	7
Exact Mass	476.19943
Heavy Atoms	34
Complexity	722.0

Chemical Identifiers

CAS Number	96546-96-2
SMILES	`CCC1=NC2=CC=CC=C2C(=N1)OCC3=NN(C(=S)O3)CN4CCN(CC4)C5=CC=C(C=C5)C`
InChIKey	`BSURCHUTWLVWTA-UHFFFAOYSA-N`

📖 Product Overview

BRN 5674405 (CAS: 96546-96-2) is a chemical compound with molecular formula C25H28N6O2S and molecular weight 476.6 g/mol. Its IUPAC systematic name is 5-[(2-ethylquinazolin-4-yl)oxymethyl]-3-[[4-(4-methylphenyl)piperazin-1-yl]methyl]-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 7 Exact Mass 476.19943 Heavy Atoms 34 Complexity 722.0 InChI Key: BSURCHUTWLVWTA-UHFFFAOYSA-N. SMILES: CCC1=NC2=CC=CC=C2C(=N1)OCC3=NN(C(=S)O3)CN4CCN(CC4)C5=CC=C(C=C5)C.

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