1-Bromo-5-methylhexane → HCID 117748657, compound

HRID 1775867Notes

Reaction equation

[C:1]([C:5]1[CH:46]=[CH:45][C:8]([C:9]([NH:11][C@@H:12]([CH2:25][C:26]2[CH:31]=[CH:30][C:29]([C:32]3[N:37]=[CH:36][C:35]([C:38]4[CH:43]=[CH:42][C:41]([OH:44])=[CH:40][CH:39]=4)=[CH:34][N:33]=3)=[CH:28][CH:27]=2)[C:13]([NH:15][CH2:16][CH2:17][C:18]([O:20][C:21]([CH3:24])([CH3:23])[CH3:22])=[O:19])=[O:14])=[O:10])=[CH:7][CH:6]=1)([CH3:4])([CH3:3])[CH3:2].Br[CH2:48][CH2:49][CH2:50][CH2:51][CH:52]([CH3:54])[CH3:53]>>[C:1]([C:5]1[CH:6]=[CH:7][C:8]([C:9]([NH:11][C@@H:12]([CH2:25][C:26]2[CH:31]=[CH:30][C:29]([C:32]3[N:33]=[CH:34][C:35]([C:38]4[CH:43]=[CH:42][C:41]([O:44][CH2:48][CH2:49][CH2:50][CH2:51][CH:52]([CH3:54])[CH3:53])=[CH:40][CH:39]=4)=[CH:36][N:37]=3)=[CH:28][CH:27]=2)[C:13]([NH:15][CH2:16][CH2:17][C:18]([O:20][C:21]([CH3:24])([CH3:23])[CH3:22])=[O:19])=[O:14])=[O:10])=[CH:45][CH:46]=1)([CH3:2])([CH3:3])[CH3:4]

Participants

Reactant 2

HCID 5207261-Bromo-5-methylhexane

HCID 117748656HCID 117748656, compound

Product 1

HCID 117748657HCID 117748657, compound

Procedure

Prepared using General Procedure 12 from tert-butyl (S)-3-(2-(4-(tert-butyl)benzamido)-3-(4-(5-(4-hydroxyphenyl)pyrimidin-2-yl)phenyl)propanamido)propanoate and 1-bromo-5-methyl hexane. LCMS-ESI (m/z) calculated for C44H56N4O5: 720.9. found 721.4 [M+H]+, tR=5.39 min. (Method 16).

Workup

customPrepared

Sources & evidence

ORD record: ord-39462fa5b4874bd09ea3494cee714f22
Source dataset: uspto-grants-2016_02
DOI: 10.6084/m9.figshare.5104873.v1
Patent number: US09260427B2

Reaction notes

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