N-[N-[4-(2,2,2-trifluoroethoxy)-6-methylpyrimidin-2-yl]-N-methylaminocarbonyl]-2-thiophenesulfonamide
Basic information
- Standard SMILES
Cc1cc(OCC(F)(F)F)nc(N(C)C(=O)NS(=O)(=O)c2cccs2)n1- InChIKey
RPSIYYYBOAOPIA-UHFFFAOYSA-N- Molecular formula
- C13H13F3N4O4S2
- Average molar mass
- 410.4 g/mol
- Monoisotopic mass
- 410.03303174
Names & identifiers
- Preferred name
- N-[N-[4-(2,2,2-trifluoroethoxy)-6-methylpyrimidin-2-yl]-N-methylaminocarbonyl]-2-thiophenesulfonamide
- IUPAC
- 1-methyl-1-[4-methyl-6-(2,2,2-trifluoroethoxy)pyrimidin-2-yl]-3-thiophen-2-ylsulfonylurea
Names & synonyms
N-[N-[4-(2,2,2-trifluoroethoxy)-6-methylpyrimidin-2-yl]-N-methylaminocarbonyl]-2-thiophenesulfonamideSCHEMBL10752855
Database identifiers
- PubChem CID
- 20189874
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 138 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 599
Related reactions
3 records
Compound notes
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