Hydrochloric Acid → HCID 69520874, compound

HRID 1294674Notes

Reaction equation

HRID 1294674 reaction equation
[N:1]12[CH2:8][CH2:7][CH:4]([CH2:5][CH2:6]1)[CH:3]([O:9][C:10]1[CH:15]=[CH:14][C:13]([N:16]([C:26]3[C:30]4[CH:31]=[CH:32][CH:33]=[CH:34][C:29]=4[S:28][CH:27]=3)[C:17]3[C:21]4[CH:22]=[CH:23][CH:24]=[CH:25][C:20]=4[S:19][CH:18]=3)=[CH:12][CH:11]=1)[CH2:2]2.[ClH:35].O1CCOCC1>C(OCC)(=O)C>[ClH:35].[N:1]12[CH2:8][CH2:7][CH:4]([CH2:5][CH2:6]1)[CH:3]([O:9][C:10]1[CH:11]=[CH:12][C:13]([N:16]([C:26]3[C:30]4[CH:31]=[CH:32][CH:33]=[CH:34][C:29]=4[S:28][CH:27]=3)[C:17]3[C:21]4[CH:22]=[CH:23][CH:24]=[CH:25][C:20]=4[S:19][CH:18]=3)=[CH:14][CH:15]=1)[CH2:2]2

Participants

5

Reactant 3

HCID 313Hydrochloric AcidHCID 312751,4-DioxaneHCID 11271636HCID 11271636, compound

Product 1

HCID 69520874HCID 69520874, compound

Reagents, catalysts & solvents 1

HCID 8857Ethyl AcetateSolvent

Procedure

The product of Example 24A (70 mg, 0.14 mmol) in ethyl acetate (3 mL) was treated with 4M HCl in 1,4-dioxane (0.2 mL, 0.8 mmol) at ambient temperature for 10 hours. The title compound was obtained as a solid (42 mg, yield, 53%). 1H NMR (MeOH-d4, 300 MHz) δ 1.85–2.25(m, 3H), 2.30–2.40 (m, 1H), 3.17–3.44 (m, 6H), 3.60–3.68 (m, 1H), 4.61 (m, 1H), 6.56–6.68 (m, 4H), 7.26–7.44 (m, 5H), 7.61–7.67 (m, 2H), 7.84–7.97 (m, 3H) ppm. MS (DCl/NH3) m/z 483 (M+H)+. Anal. Calculated for C29H26N2OS2.HCl.1.5H2O: C, 63.78; H 5.54; N, 5.13. Found: C, 63.76; H, 5.65 ; 4.84.

Sources & evidence

ORD record
ord-cb636f16e0df46b5af65c7d6d0f6e9a1
Source dataset
uspto-grants-2007_07
Patent number
US07241773B2

Reaction notes

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