5-methyl-N-(2-thienylmethyl)-2-[(2,2,2-trifluoroacetyl)amino]benzenecarboxamide
Basic information
- CAS
329700-01-8- Standard SMILES
Cc1ccc(NC(=O)C(F)(F)F)c(C(=O)NCc2cccs2)c1- InChIKey
ZQDOKGUDCYSCKO-UHFFFAOYSA-N- Molecular formula
- C15H13F3N2O2S
- Average molar mass
- 342.3 g/mol
- Monoisotopic mass
- 342.06498332
Names & identifiers
- Preferred name
- 5-methyl-N-(2-thienylmethyl)-2-[(2,2,2-trifluoroacetyl)amino]benzenecarboxamide
- IUPAC
- 5-methyl-N-(thiophen-2-ylmethyl)-2-[(2,2,2-trifluoroacetyl)amino]benzamide
Names & synonyms
329700-01-85-methyl-N-[(thiophen-2-yl)methyl]-2-(2,2,2-trifluoroacetamido)benzamide5-methyl-N-(2-thienylmethyl)-2-[(2,2,2-trifluoroacetyl)amino]benzenecarboxamide5-methyl-N-(thiophen-2-ylmethyl)-2-[(2,2,2-trifluoroacetyl)amino]benzamideDTXSID401153357AKOS005108216MS-2070SR-01000309941SR-01000309941-15-Methyl-N-(2-thienylmethyl)-2-[(2,2,2-trifluoroacetyl)amino]benzamide5-Methyl-N-(thiophen-2-ylmethyl)-2-(2,2,2-trifluoroacetamido)benzamide
Database identifiers
- CAS
329700-01-8- PubChem CID
- 677964
- DTXSID
DTXSID401153357
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 86.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 445
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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