Benzene, 1-isocyanato-4-nitro- → HCID 18465285, compound

HRID 2230095Notes

Reaction equation

HRID 2230095 reaction equation
C(O[C:6]([N:8]1[CH2:13][CH2:12][N:11]([N:14]2[C:19]3=[N:20][CH:21]=[N:22][C:18]3=[CH:17][N:16]([OH:23])[CH2:15]2)[CH2:10][CH2:9]1)=[O:7])(C)(C)C.[N+](C1C=CC(N=C=O)=CC=1)([O-])=O.[O:36]([C:43]1[CH:48]=[CH:47][C:46]([N:49]=C=O)=[CH:45][CH:44]=1)[C:37]1[CH:42]=[CH:41][CH:40]=[CH:39][CH:38]=1>>[O:36]([C:43]1[CH:44]=[CH:45][C:46]([NH:49][C:6]([N:8]2[CH2:9][CH2:10][N:11]([N:14]3[C:19]4=[N:20][CH:21]=[N:22][C:18]4=[CH:17][N:16]([OH:23])[CH2:15]3)[CH2:12][CH2:13]2)=[O:7])=[CH:47][CH:48]=1)[C:37]1[CH:42]=[CH:41][CH:40]=[CH:39][CH:38]=1

Participants

4

Reactant 3

HCID 66012Benzene, 1-isocyanato-4-nitro-HCID 27348964-Phenoxyphenyl isocyanateHCID 70153914HCID 70153914, compound

Product 1

HCID 18465285HCID 18465285, compound

Procedure

The target compound was produced in the same manner as in Example 2, except that 4-(6-purinyl)-1-piperazinecarboxylic acid tert-butyl ester was replaced with 4-(6-hydroxy-4-imidazo[4, 5-d]pyrimidinyl )-1-piperazinecarboxylic acid tert-butyl ester produced in Reference Example 11, and that 4-nitrophenyl isocyanate was replaced with 4-phenoxyphenyl isocyanate.

Workup

  1. customproduced in Reference Example 11

Sources & evidence

ORD record
ord-897b3d0823f74e7bafa484ab0624248d
Source dataset
uspto-grants-2002_07
Patent number
US06423716B1

Reaction notes

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