홈MCP워크벤치Skills
홈워크벤치알림마이페이지
llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
  1. 홈
  2. /반응

Dimethylformamide → 3-((2-tert-butoxycarbonylamino-2-methyl-3-phenylpropoxy)methyl)-5-(1-cyanocyclopentyl)-N-(1-(4-fluorophenyl)ethyl)benzamide

HRID 212927
노트
인쇄 미리보기

반응식

HRID 212927 반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][C:9]([CH2:10][O:11][CH2:12][c:13]1[cH:14][c:15]([C:16](=[O:17])[OH:18])[cH:19][c:20]([C:22]2([C:27]#[N:28])[CH2:23][CH2:24][CH2:25][CH2:26]2)[cH:21]1)([CH2:29][c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1)[CH3:36].[CH:74]([N:75]([CH:76]([CH3:77])[CH3:78])[CH2:79][CH3:80])([CH3:81])[CH3:82].[F:37][c:38]1[cH:39][cH:40][c:41]([CH:44]([CH3:45])[NH2:46])[cH:42][cH:43]1.[O:83]=[CH:84][N:85]([CH3:86])[CH3:87].[P-:47]([F:48])([F:49])([F:50])([F:51])([F:52])[F:53].[n:54]1([O:55][P+:56]([N:57]([CH3:58])[CH3:59])([N:60]([CH3:61])[CH3:62])[N:63]([CH3:64])[CH3:65])[c:66]2[cH:67][cH:68][cH:69][cH:70][c:71]2[n:72][n:73]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][C:9]([CH2:10][O:11][CH2:12][c:13]1[cH:14][c:15]([C:16](=[O:18])[NH:46][CH:44]([c:41]2[cH:40][cH:39][c:38]([F:37])[cH:43][cH:42]2)[CH3:45])[cH:19][c:20]([C:22]2([C:27]#[N:28])[CH2:23][CH2:24][CH2:25][CH2:26]2)[cH:21]1)([CH2:29][c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1)[CH3:36]
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 1230631-(4-Fluorophenyl)ethylamineHCID 124335Benzotriazol-1-yloxy-tris(dimethylamino)phosphoniumHCID 673191833-((2-Tert-butoxycarbonylamino-2-methyl-3-phenylpropoxy)methyl)-5-(1-cyanocyclopentyl)benzoic acid

생성물

1
HCID 673195433-((2-tert-butoxycarbonylamino-2-methyl-3-phenylpropoxy)methyl)-5-(1-cyanocyclopentyl)-N-(1-(4-fluorophenyl)ethyl)benzamide

출처 및 근거

ORD 기록
ord-5eb93cb5fcd24221b64561cd0de8ec67
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

반응 노트

불러오는 중…

이 페이지에서참가 물질출처 및 근거반응 노트