Formic Acid → HCID 178426402, compound

HRID 526574Notes

Reaction equation

HRID 526574 reaction equation
[CH3:1][N:2]1[CH2:8][CH2:7][CH2:6][NH:5][CH2:4][CH2:3]1.[C:9]([C:11]1[CH:16]=[CH:15][C:14]([C:17]2[CH:18]=[N:19][N:20]([C:23]3[CH:31]=[CH:30][C:26]([C:27](O)=[O:28])=[CH:25][N:24]=3)[C:21]=2[OH:22])=[C:13]([CH3:32])[CH:12]=1)#[N:10].C(O)=O>>[OH:22][C:21]1[N:20]([C:23]2[CH:31]=[CH:30][C:26]([C:27]([N:5]3[CH2:6][CH2:7][CH2:8][N:2]([CH3:1])[CH2:3][CH2:4]3)=[O:28])=[CH:25][N:24]=2)[N:19]=[CH:18][C:17]=1[C:14]1[CH:15]=[CH:16][C:11]([C:9]#[N:10])=[CH:12][C:13]=1[CH3:32]

Participants

4

Reactant 3

HCID 284Formic AcidHCID 2283491-MethylhomopiperazineHCID 178426451HCID 178426451, compound

Product 1

HCID 178426402HCID 178426402, compound

Procedure

The title compound was prepared in a manner similar to Example 284 using 1-methyl-1,4-diazepane and 6-(4-(4-cyano-2-methylphenyl)-5-hydroxy-1H-pyrazol-1-yl)nicotinic acid to give a formic acid salt (67 mg, 0.145 mmol, 77%) as an off-white solid. MS: 417 (M+H). 1H NMR (400 MHz, DMSO-d6) δ ppm 1.88 (br. s., 2H) 2.35 (s, 3H) 2.54 (br. s., 2H) 2.86 (d, J=17.7 Hz, 3H) 3.01 (br. s., 1H) 3.39-3.76 (m, 5H) 7.45 (d, J=8.1 Hz, 1H) 7.50 (s, 1H) 7.78-7.91 (m, 2H) 8.04 (d, J=7.6 Hz, 1H) 8.42 (br. s., 2H) 11.65 (br. s., 1H)

Sources & evidence

ORD record
ord-5a04624f3e0e4f9a8d3a561bb0698c3e
Source dataset
uspto-grants-2016_05
Patent number
US09345713B2

Reaction notes

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