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

Potassium Cation → cis-2-(4-{4-amino-1-[4-(4-methylpiperazino)cyclohexyl]-1H-pyrazolo[3,4-d]pyrimidin-3-yl}phenoxy)-6-(2-pyridylsulfanyl)benzonitrile

HRID 945994
노트
인쇄 미리보기

반응식

HRID 945994 반응식
[C:47](=[O:48])([O-:49])[O-:50].[CH3:55][N:56]([CH3:57])[CH:58]=[O:59].[CH3:60][CH2:61][O:62][C:63](=[O:64])[CH3:65].[F:31][c:32]1[c:33]([C:34]#[N:35])[c:36]([S:40][c:41]2[n:42][cH:43][cH:44][cH:45][cH:46]2)[cH:37][cH:38][cH:39]1.[K+:51].[K+:52].[NH2:1][c:2]1[c:3]2[c:4]([n:5][cH:6][n:7]1)[n:8]([CH:18]1[CH2:19][CH2:20][CH:21]([N:24]3[CH2:25][CH2:26][N:27]([CH3:30])[CH2:28][CH2:29]3)[CH2:22][CH2:23]1)[n:9][c:10]2-[c:11]1[cH:12][cH:13][c:14]([OH:17])[cH:15][cH:16]1.[Na+:54].[OH-:53]>>[NH2:1][c:2]1[c:3]2[c:4]([n:5][cH:6][n:7]1)[n:8]([CH:18]1[CH2:19][CH2:20][CH:21]([N:24]3[CH2:25][CH2:26][N:27]([CH3:30])[CH2:28][CH2:29]3)[CH2:22][CH2:23]1)[n:9][c:10]2-[c:11]1[cH:12][cH:13][c:14]([O:17][c:32]2[c:33]([C:34]#[N:35])[c:36]([S:40][c:41]3[n:42][cH:43][cH:44][cH:45][cH:46]3)[cH:37][cH:38][cH:39]2)[cH:15][cH:16]1
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 813Potassium Cation2회HCID 923Sodium IonHCID 961HydroxideHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 44564116-Fluoro-2-(2-pyridylthio)benzenecarbonitrile
HCID 135841422
4-{4-amino-1-[4-(4-methylpiperazino)cyclohexyl]-1H-pyrazolo[3,4-d]pyrimidin-3-yl}phenol

생성물 1

HCID 20816987cis-2-(4-{4-amino-1-[4-(4-methylpiperazino)cyclohexyl]-1H-pyrazolo[3,4-d]pyrimidin-3-yl}phenoxy)-6-(2-pyridylsulfanyl)benzonitrile

출처 및 근거

ORD 기록
ord-fa06f930a5364d15b1f2ec094f71aafc
출처 데이터셋
Validation data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

반응 노트

불러오는 중…

이 페이지에서참가 물질출처 및 근거반응 노트