2-Fluoro-1-(4-methoxyphenyl)-2-(2-pyridinylsulfonyl)ethanone

HCID 135073716

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 1365765-67-8
Standard SMILES: COc1ccc(C(=O)C(F)S(=O)(=O)c2ccccn2)cc1
InChIKey: ZVBBXLTWDFNKGV-UHFFFAOYSA-N
Molecular formula: C14H12FNO4S
Average molar mass: 309.31 g/mol
Monoisotopic mass: 309.0471072

Names & identifiers

Preferred name: 2-Fluoro-1-(4-methoxyphenyl)-2-(2-pyridinylsulfonyl)ethanone
IUPAC: 2-fluoro-1-(4-methoxyphenyl)-2-pyridin-2-ylsulfonylethanone

Names & synonyms

1365765-67-82-Fluoro-1-(4-methoxyphenyl)-2-(2-pyridinylsulfonyl)ethanoneRefChem:260807SCHEMBL30358642SCHEMBL30358643DTXSID0011841562-Fluoro-1-(4-methoxyphenyl)-2-(pyridin-2-ylsulfonyl)ethan-1-one2-Fluoro-1-(4-methoxyphenyl)-2-(pyridine-2-sulfonyl)ethan-1-oneEthanone, 2-fluoro-1-(4-methoxyphenyl)-2-(2-pyridinylsulfonyl)- (ACI); 2-Fluoro-1-(4-methoxyphenyl)-2-(2-pyridinylsulfonyl)ethanone (ACI)

Database identifiers

CAS: 1365765-67-8
PubChem CID: 135073716
DTXSID: DTXSID001184156

Properties

Computed structural properties

XLogP: 2.3
Topological polar surface area: 81.7 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 6
Rotatable bonds: 5
Heavy atoms: 21
Formal charge: 0
Complexity: 454

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…