HCID 66583148, compound → HCID 70655722, compound

HRID 1972567Notes

Reaction equation

HRID 1972567 reaction equation
[F:1][C:2]([F:37])([F:36])[C@:3]([C:6]1[CH:11]=[CH:10][C:9]([N:12]2[CH2:17][CH2:16][N:15]([S:18]([C:21]3[S:22][CH:23]=[CH:24][CH:25]=3)(=[O:20])=[O:19])[CH2:14][C@@H:13]2[CH2:26][S@:27]([C:29]2[CH:34]=[CH:33][CH:32]=[C:31]([F:35])[CH:30]=2)=[O:28])=[CH:8][CH:7]=1)([OH:5])[CH3:4].FC(F)(F)[C@@](C1C=CC(N2CCN(S(C3SC=CC=3)(=O)=O)C[C@@H]2C[S@@](C2C=CC=C(F)C=2)=O)=CC=1)(O)C.FC(F)(F)[C@@](C1C=CC(N2CCN(S(C3SC=CC=3)(=O)=O)C[C@@H]2C[S@](C2C=CC=C(F)C=2)=O)=CC=1)(O)C>>[F:37][C:2]([F:1])([F:36])[C@:3]([C:6]1[CH:7]=[CH:8][C:9]([N:12]2[CH2:17][CH2:16][N:15]([S:18]([C:21]3[S:22][CH:23]=[CH:24][CH:25]=3)(=[O:20])=[O:19])[CH2:14][C@@H:13]2[CH2:26][S@@:27]([C:29]2[CH:34]=[CH:33][CH:32]=[C:31]([F:35])[CH:30]=2)=[O:28])=[CH:10][CH:11]=1)([OH:5])[CH3:4]

Participants

4

Reactant 3

HCID 66583148HCID 66583148, compoundHCID 70655311HCID 70655311, compoundHCID 70655339HCID 70655339, compound

Product 1

HCID 70655722HCID 70655722, compound

Procedure

(2S)-1,1,1-trifluoro-2-(4-((2R)-2-(((3-fluorophenyl)-(R)-sulfinyl)methyl)-4-(2-thiophenylsulfonyl)-1-piperazinyl)phenyl)-2-propanol; (2R)-1,1,1-trifluoro-2-(4-((2R)-2-(((3-fluorophenyl)-(S)-sulfinyl)methyl)-4-(2-thiophenylsulfonyl)-1-piperazinyl)phenyl)-2-propanol; (2R)-1,1,1-trifluoro-2-(4-((2R)-2-(((3-fluorophenyl)-(R)-sulfinyl)methyl)-4-(2-thiophenylsulfonyl)-1-piperazinyl)phenyl)-2-propanol. Second Eluting Peak (Peak#2) (Mixture of Two Sulfoxide Isomers)

Sources & evidence

ORD record
ord-d3647edc2840496aa65b962848e493f0
Source dataset
uspto-grants-2013_04
Patent number
US08431563B2

Reaction notes

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