HRID1037414

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CC(C)(C)OC(=O)NC1(c2ccc(B3OC(C)(C)C(C)(C)O3)cc2)CCC1

HCID58326444

tert-Butyl {1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclobutyl}carbamate

C21H32BNO4

结构：O=C1COc2c(ccc3c(=O)c(I)c(-c4ccccc4)oc23)N1

HCID67067827

未命名化合物

结构：CC(C)(C)OC(=O)NC1(c2ccc(-c3c(-c4ccccc4)oc4c(ccc5cnn(CC#N)c54)c3=O)cc2)CCC1

HCID86671057

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NC1(c2ccc(-c3c(-c4ccccc4)oc4c5c(ccc4c3=O)NC(=O)CO5)cc2)CCC1

HCID67067975

未命名化合物

收率 52%

PROCEDURE

实验过程

Following the procedure used to prepare tert-butyl (1-(4-(1-(cyanomethyl)-6-oxo-8-phenyl-1,6-dihydropyrano[3,2-g]indazol-7-yl)phenyl)cyclobutyl)carbamate reacted 8-iodo-9-phenylchromeno[8,7-b][1,4]oxazine-3,7(2H,4H)-dione (150 mg, 0.358 mmol), tert-butyl 1-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)cyclobutylcarbamate (170 mg, 0.455 mmol) was reacted to give the title compound (100 mg, 52%). LCMS (Method I): RT=6.87 min, [M+H]+=539.

WORKUP

后处理

customwas reacted

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b2a17c79690b4ba991975bee860d9047
来源数据集: uspto-grants-2013_10
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08546376B2
来源说明: uspto-grants-2013_10

反应 SMILES

C(CN1C2C(=CC=C3C(=O)C([C:18]4[CH:23]=[CH:22][C:21]([C:24]5([NH:28][C:29](=[O:35])[O:30][C:31]([CH3:34])([CH3:33])[CH3:32])[CH2:27][CH2:26][CH2:25]5)=[CH:20][CH:19]=4)=C(C4C=CC=CC=4)OC3=2)C=N1)#N.I[C:43]1[C:48](=[O:49])[C:47]2[CH:50]=[CH:51][C:52]3[NH:57][C:56](=[O:58])[CH2:55][O:54][C:53]=3[C:46]=2[O:45][C:44]=1[C:59]1[CH:64]=[CH:63][CH:62]=[CH:61][CH:60]=1.CC1(C)C(C)(C)OB(C2C=CC(C3(NC(=O)OC(C)(C)C)CCC3)=CC=2)O1>>[C:31]([O:30][C:29](=[O:35])[NH:28][C:24]1([C:21]2[CH:20]=[CH:19][C:18]([C:43]3[C:48](=[O:49])[C:47]4[C:46](=[C:53]5[C:52](=[CH:51][CH:50]=4)[NH:57][C:56](=[O:58])[CH2:55][O:54]5)[O:45][C:44]=3[C:59]3[CH:60]=[CH:61][CH:62]=[CH:63][CH:64]=3)=[CH:23][CH:22]=2)[CH2:25][CH2:26][CH2:27]1)([CH3:34])([CH3:32])[CH3:33]