AC1NPJEO structure

AC1NPJEO

3,5-dimethoxy-N-[[3-[1,1,2,2-tetrafluoro-2-[1,1,2,2,3,3-hexafluoro-3-(trifluoromethoxy)propoxy]ethyl]phenyl]carbamothioyl]benzamide

Also Known As: 3,5-dimethoxy-N-[(3-{1,1,2,2-tetrafluoro-2-[1,1,2,2,3,3-hexafluoro-3-(trifluoromethoxy)propoxy]ethyl}phenyl)carbamothioyl]benzamide|(3,5-dimethoxyphenyl)-N-{[(3-{1,1,2,2-tetrafluoro-2-[1,1,2,2,3,3-hexafluoro-3- (trifluoromethoxy)propoxy]ethyl}phenyl)amino]thioxomethyl}carboxamide|3,5-dimethoxy-N-[[3-[1,1,2,2-tetrafluoro-2-[1,1,2,2,3,3-hexafluoro-3-(trifluoromethoxy)propoxy]ethyl]phenyl]carbamothioyl]benzamide|3-(3,5-DIMETHOXYBENZOYL)-1-(3-{1,1,2,2-TETRAFLUORO-2-[1,1,2,2,3,3-HEXAFLUORO-3-(TRIFLUOROMETHOXY)PROPOXY]ETHYL}PHENYL)THIOUREA

CAS: 4550-62-3
Molecular Formula C22H15F13N2O5S
Molecular Weight 666.04944 g/mol
LogP 6.8891
Topological Polar Surface Area 78.05 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 6
Rotatable Bonds 11
Exact Mass 666.04944
Monoisotopic Mass 666.04944
Heavy Atoms 43
Complexity 1316.6134

Chemical Identifiers

CAS Number 4550-62-3
SMILES COC1=CC(=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(C(OC(C(C(OC(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)OC

Product Overview

AC1NPJEO (CAS 4550-62-3), with molecular formula C22H15F13N2O5S and molecular weight 666.04944 g/mol. IUPAC: 3,5-dimethoxy-N-[[3-[1,1,2,2-tetrafluoro-2-[1,1,2,2,3,3-hexafluoro-3-(trifluoromethoxy)propoxy]ethyl]phenyl]carbamothioyl]benzamide.

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