4-Methyl-2-Pentanol → HCID 25127325, compound

HRID 2234315Notes

Reaction equation

HRID 2234315 reaction equation
Cl[C:2]1[N:12]=[C:11]2[C:5]([NH:6][C:7](=[O:20])[C:8]([CH3:19])([CH3:18])[CH2:9][N:10]2[CH:13]2[CH2:17][CH2:16][CH2:15][CH2:14]2)=[CH:4][N:3]=1.[NH2:21][C:22]1[CH:38]=[CH:37][C:25]([C:26]([NH:28][CH:29]2[CH2:34][CH2:33][N:32]([CH2:35][CH3:36])[CH2:31][CH2:30]2)=[O:27])=[CH:24][C:23]=1[O:39][CH3:40].[CH3:41]C(C)CC(O)C.O.C1(C)C=CC(S(O)(=O)=O)=CC=1>>[CH:13]1([N:10]2[CH2:9][C:8]([CH3:19])([CH3:18])[C:7](=[O:20])[N:6]([CH3:41])[C:5]3[C:11]2=[N:12][C:2]([NH:21][C:22]2[CH:38]=[CH:37][C:25]([C:26]([NH:28][CH:29]4[CH2:30][CH2:31][N:32]([CH2:35][CH3:36])[CH2:33][CH2:34]4)=[O:27])=[CH:24][C:23]=2[O:39][CH3:40])=[N:3][CH:4]=3)[CH2:17][CH2:16][CH2:15][CH2:14]1

Participants

5

Reactant 4

HCID 79104-Methyl-2-PentanolHCID 521998p-Toluenesulfonic acid monohydrateHCID 580150934-amino-N-(1-ethyl-4-piperidyl)-3-methoxy-benzamide2×HCID 581540122-Chloro-9-cyclopentyl-7,7-dimethyl-5,7,8,9-tetrahydro-pyrimido[4,5-b][1,4]diazepin-6-one2×

Product 1

HCID 25127325HCID 25127325, compound

Conditions

Temperature
160 °C

Procedure

10-chloro-2-cyclopentyl-4,4-dimethyl-2,6,9,11-tetrazabicyclo[5.4.0]undeca-8,10,12-trien-5-one (Intermediate 127; 115 mg, 0.37 mmol) and 4-amino-N-(1-ethyl-4-piperidyl)-3-methoxy-benzamide (Intermediate 190; 104 mg, 0.37 mmol) were dissolved 4-methyl-2-pentanol (3 mL). p-Toluenesulphonic acid monohydrate (142 mg, 0.74 mmol) was added and mixture heated by microwave irradiation at 160° C. for 1 hour.

Sources & evidence

ORD record
ord-55d835f475564fdca8ddedb98eefd828
Source dataset
uspto-grants-2010_05
Patent number
US07709471B2

Reaction notes

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