Isopropyl isocyanate → HCID 178457951, compound

HRID 2052997Notes

Reaction equation

[NH2:1][CH2:2][C@@H:3]1[CH2:6][C@H:5]([N:7]2[C:11]3[N:12]=[CH:13][N:14]=[C:15]([NH2:16])[C:10]=3[C:9]([C:17]3[CH:22]=[CH:21][CH:20]=[C:19]([O:23][CH2:24][C:25]4[CH:30]=[CH:29][CH:28]=[CH:27][CH:26]=4)[CH:18]=3)=[CH:8]2)[CH2:4]1.[CH3:31][CH:32]([N:34]=[C:35]=[O:36])[CH3:33]>>[NH2:16][C:15]1[C:10]2[C:9]([C:17]3[CH:22]=[CH:21][CH:20]=[C:19]([O:23][CH2:24][C:25]4[CH:30]=[CH:29][CH:28]=[CH:27][CH:26]=4)[CH:18]=3)=[CH:8][N:7]([C@@H:5]3[CH2:4][C@H:3]([CH2:2][NH:1][C:35]([NH:34][CH:32]([CH3:33])[CH3:31])=[O:36])[CH2:6]3)[C:11]=2[N:12]=[CH:13][N:14]=1

Participants

Reactant 2

HCID 61277Isopropyl isocyanate

HCID 178511294HCID 178511294, compound

Product 1

HCID 178457951HCID 178457951, compound

Procedure

cis-1-{3-[4-Amino-5-(3-benzyloxy-phenyl)-pyrrolo[2,3-d]pyrimidin-7-yl]-cyclobutylmethyl}-3-isopropyl-urea is prepared as described in Example 26 using cis-7-(3-aminomethyl-cyclobutyl)-5-(3-benzyloxy-phenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-ylamine and 2-propylisocyanate (Fluka, Buchs, Switzerland). Analytical HPLC: tR=6.37 min (Grad 2); ES-MS: m/eo=484.9.

Sources & evidence

ORD record: ord-680aa666f5af44c7ad51bedce3a8ea10
Source dataset: uspto-grants-2008_02
DOI: 10.6084/m9.figshare.5104873.v1
Patent number: US07326699B2

Reaction notes

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