2-Propenamide, N-(3-chloro-4-fluorophenyl)-3-(4-methoxyphenyl)-
Basic information
- CAS
345325-75-9- Standard SMILES
COc1ccc(C=CC(=O)Nc2ccc(F)c(Cl)c2)cc1- InChIKey
JGWUQTBCUCTPMT-UHFFFAOYSA-N- Molecular formula
- C16H13ClFNO2
- Average molar mass
- 305.73 g/mol
- Monoisotopic mass
- 305.0618845
Names & identifiers
- Preferred name
- 2-Propenamide, N-(3-chloro-4-fluorophenyl)-3-(4-methoxyphenyl)-
- IUPAC
- N-(3-chloro-4-fluorophenyl)-3-(4-methoxyphenyl)prop-2-enamide
Names & synonyms
345325-75-9N-(3-chloro-4-fluorophenyl)-3-(4-methoxyphenyl)prop-2-enamide2-Propenamide, N-(3-chloro-4-fluorophenyl)-3-(4-methoxyphenyl)-DTXSID50355592
Database identifiers
- CAS
345325-75-9- PubChem CID
- 808149
- DTXSID
DTXSID50355592
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 369
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Compound notes
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