Cyclopropylamine → HCID 178480525, compound

HRID 1204501Notes

Reaction equation

[C:41]([P:42](=[O:43])([O:44][CH2:45][CH3:46])[O:47][CH2:48][CH3:49])#[N:50].[CH:37]1([NH2:40])[CH2:38][CH2:39]1.[Cl:1][c:2]1[cH:3][c:4]2[c:5]([CH2:11][n:12]3[n:13][c:14]4[n:15]([CH2:33][CH:34]5[CH2:35][CH2:36]5)[c:16](=[O:32])[n:17]([CH3:31])[c:18](=[O:30])[c:19]4[c:20]3-[c:21]3[cH:22][c:23]([C:27](=[O:28])[OH:29])[cH:24][n:25]3[CH3:26])[n:6][nH:7][c:8]2[cH:9][cH:10]1>>[Cl:1][c:2]1[cH:3][c:4]2[c:5]([CH2:11][n:12]3[n:13][c:14]4[n:15]([CH2:33][CH:34]5[CH2:35][CH2:36]5)[c:16](=[O:32])[n:17]([CH3:31])[c:18](=[O:30])[c:19]4[c:20]3-[c:21]3[cH:22][c:23]([C:27](=[O:28])[NH:40][CH:37]4[CH2:38][CH2:39]4)[cH:24][n:25]3[CH3:26])[n:6][nH:7][c:8]2[cH:9][cH:10]1

Participants

Reactant 3

HCID 69828Cyclopropylamine

HCID 76257Diethyl cyanophosphonate

HCID 1784805425-[2-[(5-chloro-1H-indazol-3-yl)methyl]-7-(cyclopropylmethyl)-5-methyl-4,6-dioxo-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-d]pyrimidin-3-yl]-1-methyl-1H-pyrrole-3-carboxylic acid

Product 1

HCID 178480525HCID 178480525, compound

Sources & evidence

ORD record: ord-8190493c3fb6404cb7d21e26ba0bcbf6
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

Reaction notes

Loading…