Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Methyl Isocyanate | HCID 12228 | — |
| Reactant | HCID 59631072 | HCID 59631072 | — |
| Product | HCID 67508737 | HCID 67508737 | — |
Reaction Steps
Prepared according to Procedure N using (S)-5,7-difluoro-3-methyl-2-(3-methylpiperazin-1-yl)-N-(5-morpholinopyridin-3-yl)quinolin-4-amine (50.0 mg, 0.11 mmol) and methylisocyanate to give (S)-4-(5,7-difluoro-3-methyl-4-(5-morpholinopyridin-3-ylamino)quinolin-2-yl)-N,2-dimethylpiperazine-1-carboxamide. 1H NMR (CDCl3) δ ppm 7.94 (1H, d, J=2.5 Hz), 7.69 (1H, d, J=2.2 Hz), 7.30 (1H, ddd, J=10.0, 2.5, 1.2 Hz), 6.90 (1H, d, J=13.3 Hz), 6.81 (1H, ddd, J=13.8, 8.7, 2.5 Hz), 6.59 (1H, t, J=2.3 Hz), 4.49 (1H, q, J=4.9 Hz), 4.18-4.31 (1H, m), 3.78-3.91 (5H, m), 3.69-3.78 (1H, m), 3.60 (1H, dt, J=12.8, 1.7 Hz), 3.37 (1H, td, J=12.4, 3.1 Hz), 3.09-3.23 (5H, m), 2.96 (1H, td, J=12.4, 3.5 Hz), 2.87 (3H, d, J=4.7 Hz), 2.10 (3H, s), 1.31 (3H, d). Mass Spectrum (ESI) m/e=512.2 (M+1).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08940724B2 |
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| Source dataset | uspto-grants-2015_01 |
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| ORD ID | ord-3cfa6168e152429dac4879e2922212a6 |
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| Source note | uspto-grants-2015_01 |
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