AC1LSEED structure

AC1LSEED

methyl 4-[[1-methyl-6-oxo-4-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]benzoate

Also Known As: Bionet1_001544|HMS572J06|KS-00003EH0|8J-520S|methyl 4-[[1-methyl-6-oxo-4-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]benzoate|Methyl 4-(((1-methyl-6-oxo-4-(trifluoromethyl)-1,6-dihydro-2-pyrimidinyl)sulfanyl)methyl)benzenecarboxylate|methyl 4-({[1-methyl-6-oxo-4-(trifluoromethyl)-1,6-dihydro-2-pyrimidinyl]sulfanyl}methyl)benzenecarboxylate|methyl 4-({[1-methyl-6-oxo-4-(trifluoromethyl)-1,6-dihydropyrimidin-2-yl]sulfanyl}methyl)benzoate

CAS: 339101-75-6
Molecular Formula C15H13F3N2O3S
Molecular Weight 358.0599 g/mol
LogP 2.878
Topological Polar Surface Area 61.19 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 4
Exact Mass 358.0599
Monoisotopic Mass 358.0599
Heavy Atoms 24
Complexity 801.09204

Chemical Identifiers

CAS Number 339101-75-6
SMILES CN1C(=O)C=C(N=C1SCC2=CC=C(C=C2)C(=O)OC)C(F)(F)F

Product Overview

AC1LSEED (CAS 339101-75-6), with molecular formula C15H13F3N2O3S and molecular weight 358.0599 g/mol. IUPAC: methyl 4-[[1-methyl-6-oxo-4-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]benzoate.

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