{2-[3-(2-Fluoro-3-methoxy-phenyl)-5-(2-fluoro-6-trifluoromethyl-benzyl)-2,4,6-trioxo-[1,3,5]triazinan-1-yl]-1,1-dimethyl-ethyl}-carbamic acid tert-butyl ester

HCID 69892014
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Basic information

Standard SMILES
COc1cccc(-n2c(=O)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(CC(C)(C)NC(=O)OC(C)(C)C)c2=O)c1F
InChIKey
JIQWVPWCDZTVBT-UHFFFAOYSA-N
Molecular formula
C27H29F5N4O6
Average molar mass
600.5 g/mol

Names & identifiers

Preferred name
{2-[3-(2-Fluoro-3-methoxy-phenyl)-5-(2-fluoro-6-trifluoromethyl-benzyl)-2,4,6-trioxo-[1,3,5]triazinan-1-yl]-1,1-dimethyl-ethyl}-carbamic acid tert-butyl ester
IUPAC
tert-butyl N-[1-[3-(2-fluoro-3-methoxyphenyl)-5-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]-2-methylpropan-2-yl]carbamate

Names & synonyms

{2-[3-(2-Fluoro-3-methoxy-phenyl)-5-(2-fluoro-6-trifluoromethyl-benzyl)-2,4,6-trioxo-[1,3,5]triazinan-1-yl]-1,1-dimethyl-ethyl}-carbamic acid tert-butyl esterSCHEMBL6772910

Database identifiers

PubChem CID
69892014

Properties

Computed structural properties

XLogP
4.8
Topological polar surface area
108 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
11
Rotatable bonds
9
Heavy atoms
42

Related reactions

2 records
New reaction record

Compound notes

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