Tert-butyl 1,4-diazepane-1-carboxylate → HCID 42643885, compound

HRID 831162Notes

Reaction equation

HRID 831162 reaction equation
[C:1](=[O:2])([OH:3])[CH2:4][CH2:5][c:6]1[c:7]([O:8][CH2:9][CH2:10][CH2:11][C:12](=[O:13])[OH:14])[cH:15][cH:16][cH:17][c:18]1[CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][O:25][c:26]1[cH:27][c:28](-[c:40]2[cH:41][c:42]([F:46])[cH:43][cH:44][cH:45]2)[cH:29][c:30]([C:32]([N:33]2[CH2:34][CH2:35][NH:36][CH2:37][CH2:38]2)=[O:39])[cH:31]1.[C:92]([O:93][C:97](=[O:98])[N:99]1[CH2:100][CH2:101][NH:102][CH2:103][CH2:104][CH2:105]1)([CH3:94])([CH3:95])[CH3:96].[CH2:47]([O:48][C:49]([CH2:50][CH2:51][c:52]1[c:53]([O:54][CH2:55][CH2:56][CH2:57][C:58]([O:59][CH2:60][CH3:61])=[O:62])[cH:63][cH:64][cH:65][c:66]1[CH2:67][CH2:68][CH2:69][CH2:70][CH2:71][CH2:72][O:73][c:74]1[cH:75][c:76]([C:77]([OH:78])=[O:79])[cH:80][c:81](-[c:82]2[cH:83][cH:84][cH:85][c:86]([F:87])[cH:88]2)[cH:89]1)=[O:90])[CH3:91]>>[C:1](=[O:2])([OH:3])[CH2:4][CH2:5][c:6]1[c:7]([O:8][CH2:9][CH2:10][CH2:11][C:12](=[O:13])[OH:14])[cH:15][cH:16][cH:17][c:18]1[CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][O:25][c:26]1[cH:27][c:28](-[c:40]2[cH:41][c:42]([F:46])[cH:43][cH:44][cH:45]2)[cH:29][c:30]([C:97](=[O:98])[N:99]2[CH2:100][CH2:101][NH:102][CH2:103][CH2:104][CH2:105]2)[cH:31]1

Participants

4

Reactant 3

HCID 2756058Tert-butyl 1,4-diazepane-1-carboxylateHCID 426436304-(2-(2-Carboxy-ethyl)-3-{6-[3'-fluoro-5-(piperazine-1-carbonyl)-biphenyl-3-yloxy]-hexyl}-phenoxy)-butyric AcidHCID 67338077HCID 67338077, compound

Product 1

HCID 42643885HCID 42643885, compound

Sources & evidence

ORD record
ord-2e3fc5a856f944b097c8b0514e43d6ea
Source dataset
Test data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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