Ammonia → HCID 44546483, compound

HRID 390487Notes

Reaction equation

HRID 390487 reaction equation
[OH:1][N:2]=[C:3](Cl)[C:4]1[CH:5]=[N:6][CH:7]=[N:8][CH:9]=1.[C:11]([C:13]1[CH:18]=[CH:17][C:16]([CH3:19])=[CH:15][CH:14]=1)#[CH:12].N>>[N:6]1[CH:5]=[C:4]([C:3]2[CH:12]=[C:11]([C:13]3[CH:18]=[CH:17][C:16]([CH3:19])=[CH:15][CH:14]=3)[O:1][N:2]=2)[CH:9]=[N:8][CH:7]=1

Participants

4

Reactant 3

HCID 222AmmoniaHCID 13018p-EthynyltolueneHCID 86636847N-Hydroxypyrimidine-5-carbimidoyl chloride

Product 1

HCID 44546483HCID 44546483, compound

Procedure

The titled compound was prepared as the hydrochloride salt according to Method CB using the product of Example 44B (79 mg, 0.5 mmol) and 1-ethynyl-4-methylbenzene (Apollo, 58 mg, 0.5 mmol). 1H NMR (300 MHz, DMSO-d6) δ 2.40 (s, 3H), 7.42 (d, J=8.1 Hz, 2H), 7.70 (s, 1H), 7.81 (d, J=8.5 Hz, 2H), 9.32 (s, 2H), 9.34 (s, 1H) ppm; MS (DCI/NH3) m/z 238 (M+H)+.

Sources & evidence

ORD record
ord-f4d2cbcfaf9a48829206e818c0e014da
Source dataset
uspto-grants-2013_02
Patent number
US08383658B2

Reaction notes

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