AC1LQZEJ structure

AC1LQZEJ

1-[5-[(4-chlorophenyl)methylsulfanylmethyl]-1,3,4-thiadiazol-2-yl]-3-(2-fluorophenyl)urea

Also Known As: Oprea1_455230|AB00106680-01|1-(5-(((4-chlorobenzyl)thio)methyl)-1,3,4-thiadiazol-2-yl)-3-(2-fluorophenyl)urea|1-(5-{[(4-chlorobenzyl)sulfanyl]methyl}-1,3,4-thiadiazol-2-yl)-3-(2-fluorophenyl)urea|1-[5-[(4-chlorophenyl)methylsulfanylmethyl]-1,3,4-thiadiazol-2-yl]-3-(2-fluorophenyl)urea|N-(5-{[(4-chlorobenzyl)thio]methyl}-1,3,4-thiadiazol-2-yl)-N'-(2-fluorophenyl)urea|1-[(2E)-5-{[(4-chlorobenzyl)sulfanyl]methyl}-1,3,4-thiadiazol-2(3H)-ylidene]-3-(2-fluorophenyl)urea

CAS: 428482-87-5
Molecular Formula C17H14ClFN4OS2
Molecular Weight 408.02817 g/mol
LogP 5.408
Topological Polar Surface Area 66.91 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 5
Rotatable Bonds 6
Exact Mass 408.02817
Monoisotopic Mass 408.02817
Heavy Atoms 26
Complexity 888.4792

Chemical Identifiers

CAS Number 428482-87-5
SMILES C1=CC=C(C(=C1)NC(=O)NC2=NN=C(S2)CSCC3=CC=C(C=C3)Cl)F

Product Overview

AC1LQZEJ (CAS 428482-87-5), with molecular formula C17H14ClFN4OS2 and molecular weight 408.02817 g/mol. IUPAC: 1-[5-[(4-chlorophenyl)methylsulfanylmethyl]-1,3,4-thiadiazol-2-yl]-3-(2-fluorophenyl)urea.

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