Name: Name:3-Chloro-n-(3-chloro-4-fluorophenyl)propanamide
Brand: AABLOCKS
SKU: AA000ZEG
Rating: 90 (10 reviews)

Technical Information

Catalog Number: AA000ZEG

Chemical Name: 3-Chloro-n-(3-chloro-4-fluorophenyl)propanamide

CAS Number: 131605-66-8

Molecular Formula: C9H8Cl2FNO

Molecular Weight: 236.0703

MDL Number: MFCD01213651

SMILES: ClCCC(=O)Nc1ccc(c(c1)Cl)F

Properties

Complexity: 203

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 14

Hydrogen Bond Acceptor Count: 2

Hydrogen Bond Donor Count: 1

Isotope Atom Count: 0

Rotatable Bond Count: 3

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 2.6

Downstream Synthesis Route

367-21-5

625-36-5

131605-66-8

[1]CurrentPatentAssignee:UNIVERSITYOFILLINOIS(SYSTEM)-WO2017/142883,2017,A1Locationinpatent:Paragraph0193-0194

[2]Shen,Sida;Picci,Cristina;Ustinova,Kseniya;Benoy,Veronick;Kutil,Zsófia;Zhang,Guiping;Tavares,MaurícioT.;Pavlíček,Jiří;Zimprich,ChadA.;Robers,MatthewB.;VanDenBosch,Ludo;Bařinka,Cyril;Langley,Brett;Kozikowski,AlanP.[JournalofMedicinalChemistry,2021,vol.64,#8,p.4810-4840]

131605-66-8

7-chloro-6-fluoro-3,4-dihydroquinolin-2(1H)-one(7-2)

[1]CurrentPatentAssignee:UNIVERSITYOFILLINOIS(SYSTEM)-WO2017/142883,2017,A1Locationinpatent:Paragraph0193;0195

[2]Shen,Sida;Picci,Cristina;Ustinova,Kseniya;Benoy,Veronick;Kutil,Zsófia;Zhang,Guiping;Tavares,MaurícioT.;Pavlíček,Jiří;Zimprich,ChadA.;Robers,MatthewB.;VanDenBosch,Ludo;Bařinka,Cyril;Langley,Brett;Kozikowski,AlanP.[JournalofMedicinalChemistry,2021,vol.64,#8,p.4810-4840]

131605-66-8

1018819-74-3

[1]CurrentPatentAssignee:UNIVERSITYOFILLINOIS(SYSTEM)-WO2017/142883,2017,A1

[2]Shen,Sida;Picci,Cristina;Ustinova,Kseniya;Benoy,Veronick;Kutil,Zsófia;Zhang,Guiping;Tavares,MaurícioT.;Pavlíček,Jiří;Zimprich,ChadA.;Robers,MatthewB.;VanDenBosch,Ludo;Bařinka,Cyril;Langley,Brett;Kozikowski,AlanP.[JournalofMedicinalChemistry,2021,vol.64,#8,p.4810-4840]

131605-66-8

methyl4-((7-chloro-6-fluoro-3,4-dihydroquinolin-1(2H)-yl)methyl)benzoate

[1]CurrentPatentAssignee:UNIVERSITYOFILLINOIS(SYSTEM)-WO2017/142883,2017,A1

[2]Shen,Sida;Picci,Cristina;Ustinova,Kseniya;Benoy,Veronick;Kutil,Zsófia;Zhang,Guiping;Tavares,MaurícioT.;Pavlíček,Jiří;Zimprich,ChadA.;Robers,MatthewB.;VanDenBosch,Ludo;Bařinka,Cyril;Langley,Brett;Kozikowski,AlanP.[JournalofMedicinalChemistry,2021,vol.64,#8,p.4810-4840]

131605-66-8 | 3-Chloro-n-(3-chloro-4-fluorophenyl)propanamide