Phenethyl isocyanate → HCID 9846551, compound

HRID 1782072Notes

Reaction equation

[CH2:1]([N:9]=[C:10]=[O:11])[CH2:2][C:3]1[CH:8]=[CH:7][CH:6]=[CH:5][CH:4]=1.[NH2:12][C:13]1[C:22]2[C:17](=[CH:18][C:19]([O:25][CH2:26][CH:27]3[CH2:32][CH2:31][N:30]([CH3:33])[CH2:29][CH2:28]3)=[C:20]([O:23][CH3:24])[CH:21]=2)[N:16]=[CH:15][N:14]=1>>[CH3:24][O:23][C:20]1[CH:21]=[C:22]2[C:17](=[CH:18][C:19]=1[O:25][CH2:26][CH:27]1[CH2:32][CH2:31][N:30]([CH3:33])[CH2:29][CH2:28]1)[N:16]=[CH:15][N:14]=[C:13]2[NH:12][C:10]([NH:9][CH2:1][CH2:2][C:3]1[CH:8]=[CH:7][CH:6]=[CH:5][CH:4]=1)=[O:11]

Participants

Reactant 2

HCID 160602Phenethyl isocyanate

HCID 222439084-amino-6-methoxy-7-(N-methylpiperidin-4-ylmethoxy)quinazoline

Product 1

HCID 9846551HCID 9846551, compound

Procedure

Using an analogous procedure to that described in Example 3, phenethyl isocyanate was reacted with 4-amino-6methoxy-7-(N-methylpiperidin4ylmethoxy)quinazoline to give the title compound; NMR Spectrum: (CDCl3) 1.48 (m, 2H), 1.98 (m, 5H), 2.29 (s, 3H), 2.91 (m, 4H), 3.7 (q, 2H), 4.02 (d, 5H), 7.28 (m, partially obscured by CHCl3 peak), 8.47 (s, 1H), 8.65 (s, 1H), 10.1 (s, 1H); Mass Spectrum: M+H+ 450.

Sources & evidence

ORD record: ord-d6a5e42628a64b629fe82124f44b19d9
Source dataset: uspto-grants-2009_03
DOI: 10.6084/m9.figshare.5104873.v1
Patent number: US07498335B2

Reaction notes

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