HCID 86700324, compound → HCID 86700330, compound

HRID 879509Notes

Reaction equation

[C:1]([O:5][C@@H:6]([C:10]1[C:36]([CH3:37])=[CH:35][C:13]2[N:14]=[C:15]([N:17]3[CH2:22][CH2:21][N:20]([CH3:23])[CH:19]([C:24]4[CH:25]=[C:26]5[C:30](=[CH:31][CH:32]=4)[N:29]([CH3:33])[N:28]=[CH:27]5)[C:18]3=O)[S:16][C:12]=2[C:11]=1[C:38]1[CH:43]=[CH:42][C:41]([Cl:44])=[CH:40][CH:39]=1)[C:7]([OH:9])=[O:8])([CH3:4])([CH3:3])[CH3:2].[C:45](O[C@@H](C1C(C)=CC2N=C(N3CCNC(C4C=C5C(=CC=4)N(C)N=C5)C3)SC=2C=1C1C=CC(Cl)=CC=1)C(OCC)=O)(C)(C)[CH3:46]>>[C:1]([O:5][C@@H:6]([C:10]1[C:36]([CH3:37])=[CH:35][C:13]2[N:14]=[C:15]([N:17]3[CH2:22][CH2:21][N:20]([CH3:23])[CH:19]([C:24]4[CH:25]=[C:26]5[C:30](=[CH:31][CH:32]=4)[N:29]([CH3:33])[N:28]=[CH:27]5)[CH2:18]3)[S:16][C:12]=2[C:11]=1[C:38]1[CH:39]=[CH:40][C:41]([Cl:44])=[CH:42][CH:43]=1)[C:7]([O:9][CH2:45][CH3:46])=[O:8])([CH3:4])([CH3:2])[CH3:3]

Participants

Reactant 2

HCID 86700324HCID 86700324, compound

HCID 86700331HCID 86700331, compound

Product 1

HCID 86700330HCID 86700330, compound

Procedure

(2S)-ethyl 2-tert-butoxy-2-(7-(4-chlorophenyl)-5-methyl-2-(4-methyl-3-(1-methyl-1H-indazol-5-yl)piperazin-1-yl)benzo[d]thiazol-6-yl)acetate (16 mg) was prepared in a similar manner as (2S)-2-tert-butoxy-2-(7-(4-chlorophenyl)-5-methyl-2-(4-methyl-3-(1-methyl-1H-indazol-5-yl)-2-oxopiperazin-1-yl)benzo[d]thiazol-6-yl)acetic acid except using (2S)-ethyl 2-tert-butoxy-2-(7-(4-chlorophenyl)-5-methyl-2-(3-(1-methyl-1H-indazol-5-yl)piperazin-1-yl)benzo[d]thiazol-6-yl)acetate instead of (2S)-2-tert-butoxy-2-(7-(4-chlorophenyl)-5-methyl-2-(3-(1-methyl-1H-indazol-5-yl)-2-oxopiperazin-1-yl)benzo[d]thiazol-6-yl)acetic acid. LCMS-ESI+: calc'd for C35H41ClN5O3S: 646.2 (M+H+); Found: 646.3 (M+H+).

Sources & evidence

ORD record: ord-6b1929ea406b433ca4cbac5a10a9c2ae
Source dataset: uspto-grants-2015_03
DOI: 10.6084/m9.figshare.5104873.v1
Patent number: US08987250B2

Reaction notes

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