Acetonitrile → HCID 10022738, compound

HRID 2113977Notes

Reaction equation

HRID 2113977 reaction equation
[CH3:1][C:2]1[N:3]=[C:4]([NH:29][CH3:30])[S:5][C:6]=1[C:7]1[CH:12]=[CH:11][N:10]=[C:9]([NH:13][C:14]2[CH:19]=[CH:18][C:17]([N:20]3[CH2:25][CH2:24][N:23](C(=O)C)[CH2:22][CH2:21]3)=[CH:16][CH:15]=2)[N:8]=1.CC#N>Cl>[CH3:1][C:2]1[N:3]=[C:4]([NH:29][CH3:30])[S:5][C:6]=1[C:7]1[CH:12]=[CH:11][N:10]=[C:9]([NH:13][C:14]2[CH:15]=[CH:16][C:17]([N:20]3[CH2:21][CH2:22][NH:23][CH2:24][CH2:25]3)=[CH:18][CH:19]=2)[N:8]=1

Participants

4

Reactant 2

HCID 6342AcetonitrileHCID 10320107HCID 10320107, compound

Product 1

HCID 10022738HCID 10022738, compound

Reagents, catalysts & solvents 1

HCID 313Hydrochloric AcidSolvent

Procedure

By hydrolysis of 1-(4-{4-[4-(4-Methyl-2-methylamino-thiazol-5-yl)-pyrimidin-2-ylamino]-phenyl}-piperazin-1-yl)-ethanone in 2 M aq HCl. Yellow solid. Anal. RP-HPLC: tR=8.8 min (10-70% MeCN, purity>95%). 1H-NMR (DMSO-d6) δ: 2.45 (3, 3H, CH3), 2.83 (t, 4H, J=5.9 Hz, CH2), 2.85 (d, 3H, J=4.9 Hz, CH2), 2.95 (t, 4H, J=4.9 Hz, CH2), 6.81 (d, 1H, J=5.4 Hz, pyrimidinyl-H), 6.85 (d, 2H, J=9.3 Hz, Ph-H), 7.58 (d, 2H, J=8.8 Hz, Ph-H), 7.99 (m, 1H, NH), 8.26 (d, 1H, J=5.4 Hz, pyrimidinyl-H), 9.14 (brs, 1H).

Sources & evidence

ORD record
ord-96a10700e88a400385bacd97541ff285
Source dataset
uspto-grants-2008_10
Patent number
US07432260B2

Reaction notes

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