3-((1S)-1-(1-((1S)-(4-Chlorophenyl)(3-(5-oxo-4,5-dihydro-1,3,4-oxadiazol-2-yl)phenyl)methyl)azetidin-3-yl)-2-fluoro-2-methylpropyl)-5-fluorobenzonitrile

Base Information

Chemical Name:3-((1S)-1-(1-((1S)-(4-Chlorophenyl)(3-(5-oxo-4,5-dihydro-1,3,4-oxadiazol-2-yl)phenyl)methyl)azetidin-3-yl)-2-fluoro-2-methylpropyl)-5-fluorobenzonitrile
CAS No.:937731-95-8
Molecular Formula:C₂₉H₂₅ClF₂N₄O₂
Molecular Weight:534.993
Hs Code.:
UNII:W731CJI60Q

3-((1S)-1-(1-((1S)-(4-Chlorophenyl)(3-(5-oxo-4,5-dihydro-1,3,4-oxadiazol-2-yl)phenyl)methyl)azetidin-3-yl)-2-fluoro-2-methylpropyl)-5-fluorobenzonitrile

Synonyms:3-(1-(1-((4-chlorophenyl)(3-(5-oxo-4,5-dihydro-1,3,4-oxadiazol-2-yl)phenyl)methyl)azetidin-3-yl)-2-fluoro-2-methylpropyl)-5-fluorobenzonitrile;MK 7128;MK-7128;MK7128

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Chemical Property of 3-((1S)-1-(1-((1S)-(4-Chlorophenyl)(3-(5-oxo-4,5-dihydro-1,3,4-oxadiazol-2-yl)phenyl)methyl)azetidin-3-yl)-2-fluoro-2-methylpropyl)-5-fluorobenzonitrile

Chemical Property:

XLogP3:6.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:534.1634101
Heavy Atom Count:38
Complexity:940

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(C)(C(C1CN(C1)C(C2=CC=C(C=C2)Cl)C3=CC=CC(=C3)C4=NNC(=O)O4)C5=CC(=CC(=C5)C#N)F)F
Isomeric SMILES:CC(C)([C@@H](C1CN(C1)[C@@H](C2=CC=C(C=C2)Cl)C3=CC=CC(=C3)C4=NNC(=O)O4)C5=CC(=CC(=C5)C#N)F)F

Technology Process of 3-((1S)-1-(1-((1S)-(4-Chlorophenyl)(3-(5-oxo-4,5-dihydro-1,3,4-oxadiazol-2-yl)phenyl)methyl)azetidin-3-yl)-2-fluoro-2-methylpropyl)-5-fluorobenzonitrile

There total 3 articles about 3-((1S)-1-(1-((1S)-(4-Chlorophenyl)(3-(5-oxo-4,5-dihydro-1,3,4-oxadiazol-2-yl)phenyl)methyl)azetidin-3-yl)-2-fluoro-2-methylpropyl)-5-fluorobenzonitrile which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

: 75-44-5
phosgene

: 937732-35-9
3-((S)-(4-chlorophenyl){3-[(1S)-1-(3-cyano-5-fluorophenyl)-2-fluoro-2-methylpropyl]azetidin-1-yl}methyl)benzohydrazide

: 937731-95-8
3-[(1S)-1-(1-{(1S)-(4-chlorophenyl)[3-(5-oxo-4,5-dihydro-1,3,4-oxadiazol-2-yl)phenyl]methyl}azetidin-3-yl)-2-fluoro-2-methylpropyl]-5-fluorobenzonitrile

Guidance literature:: With ammonia; In methanol; dichloromethane; toluene;

Reference yield:

: 1147871-65-5
C₃₄H₃₃ClF₂N₄O₄

: 937731-95-8
3-[(1S)-1-(1-{(1S)-(4-chlorophenyl)[3-(5-oxo-4,5-dihydro-1,3,4-oxadiazol-2-yl)phenyl]methyl}azetidin-3-yl)-2-fluoro-2-methylpropyl]-5-fluorobenzonitrile

Guidance literature:: C₃₄H₃₃ClF₂N₄O₄; With hydrogenchloride; In Isopropyl acetate; isopropyl alcohol; at 20 ℃;

With sodium hydrogencarbonate; In Isopropyl acetate; water; isopropyl alcohol; pH=~ 7; Product distribution / selectivity;