HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Reaction

Water → 2-(2-Amino-pyrimidin-4-yl)-3-iodo-1-methyl-4-oxo-1,4,6,7-tetrahydro-pyrrolo[3,2-c]pyridine-5-carboxylic acid tert-butyl ester

HRID 933171
Notes
Print preview

Reaction equation

HRID 933171 reaction equation
[C:1](=[O:2])([O-:3])[O-:4].[C:7]([CH3:8])([CH3:9])([CH3:10])[O:11][C:12](=[O:13])[N:14]1[C:15](=[O:31])[c:16]2[c:17]([nH:20][c:21](-[c:24]3[n:25][c:26]([NH2:30])[n:27][cH:28][cH:29]3)[c:22]2[I:23])[CH2:18][CH2:19]1.[CH3:32][I:33].[Cl:40][CH2:41][Cl:42].[Cs+:5].[Cs+:6].[O:35]=[CH:36][N:37]([CH3:38])[CH3:39].[OH2:34]>>[CH3:1][n:20]1[c:17]2[c:16]([c:22]([I:23])[c:21]1-[c:24]1[n:25][c:26]([NH2:30])[n:27][cH:28][cH:29]1)[C:15](=[O:31])[N:14]([C:12]([O:11][C:7]([CH3:8])([CH3:9])[CH3:10])=[O:13])[CH2:19][CH2:18]2
ParticipantsSources & evidenceReaction notes

Participants

8

Reactant 7

HCID 962WaterHCID 6228DimethylformamideHCID 6328Methyl iodideHCID 6344DichloromethaneHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 67284476
2-(2-Amino-pyrimidin-4-yl)-3-iodo-4-oxo-1,4,6,7-tetrahydro-pyrrolo[3,2-c]pyridine-5-carboxylic acid tert-butyl ester

Product 1

HCID 672843262-(2-Amino-pyrimidin-4-yl)-3-iodo-1-methyl-4-oxo-1,4,6,7-tetrahydro-pyrrolo[3,2-c]pyridine-5-carboxylic acid tert-butyl ester

Sources & evidence

ORD record
ord-84043bc5ae6c4f8ebb07a096c72e31a0
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

Reaction notes

Loading…

On this pageParticipantsSources & evidenceReaction notes