AC1LXDG5 structure

AC1LXDG5

2-[(3-bromo-4-methoxyphenyl)methylsulfanyl]-5-[(4-ethoxyphenyl)methyl]-1,3,4-thiadiazole

Also Known As: Oprea1_292679|AL-281/14777002|2-[(3-bromo-4-methoxyphenyl)methylsulfanyl]-5-[(4-ethoxyphenyl)methyl]-1,3,4-thiadiazole|2-[(3-bromo-4-methoxybenzyl)sulfanyl]-5-(4-ethoxybenzyl)-1,3,4-thiadiazole|5-(3-bromo-4-methoxybenzyl)mercapto-2-(4-ethoxybenzyl)-1,3,4-thiadiazole

CAS: 354550-14-4
Molecular Formula C19H19BrN2O2S2
Molecular Weight 450.00714 g/mol
LogP 5.591
Topological Polar Surface Area 44.24 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 6
Rotatable Bonds 8
Exact Mass 450.00714
Monoisotopic Mass 450.00714
Heavy Atoms 26
Complexity 853.00037

Chemical Identifiers

CAS Number 354550-14-4
SMILES CCOC1=CC=C(C=C1)CC2=NN=C(S2)SCC3=CC(=C(C=C3)OC)Br

Product Overview

AC1LXDG5 (CAS 354550-14-4), with molecular formula C19H19BrN2O2S2 and molecular weight 450.00714 g/mol. IUPAC: 2-[(3-bromo-4-methoxyphenyl)methylsulfanyl]-5-[(4-ethoxyphenyl)methyl]-1,3,4-thiadiazole.

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