HCID 67040380, compound → HCID 67041120, compound

HRID 605419Notes

Reaction equation

[CH:1]([C:4]1[CH:5]=[CH:6][C:7]2[C:12]([NH:13][C:14]3[CH:19]=[C:18]([C:20](=[O:33])[NH:21][C@H:22]([C:27]4[CH:32]=[CH:31][CH:30]=[CH:29][CH:28]=4)[C:23]([F:26])([F:25])[F:24])[CH:17]=[CH:16][C:15]=3[S:34][C:35]3[CH:40]=[CH:39][C:38]([NH:41]C(=O)OC(C)(C)C)=[CH:37][CH:36]=3)=[N:11][CH:10]=[N:9][C:8]=2[N:49]=1)([CH3:3])[CH3:2].C(OC(=O)NC1C=CC(SC2C=CC(C(=O)N[C@H](C3C=CC=CC=3)C)=CC=2NC2C3C=CC(C(C)C)=NC=3N=CN=2)=CC=1)(C)(C)C>>[NH2:41][C:38]1[CH:39]=[CH:40][C:35]([S:34][C:15]2[CH:16]=[CH:17][C:18]([C:20]([NH:21][C@H:22]([C:27]3[CH:28]=[CH:29][CH:30]=[CH:31][CH:32]=3)[C:23]([F:24])([F:25])[F:26])=[O:33])=[CH:19][C:14]=2[NH:13][C:12]2[C:7]3[CH:6]=[CH:5][C:4]([CH:1]([CH3:3])[CH3:2])=[N:49][C:8]=3[N:9]=[CH:10][N:11]=2)=[CH:36][CH:37]=1

Participants

Reactant 2

HCID 67040380HCID 67040380, compound

HCID 71655101HCID 71655101, compound

Product 1

HCID 67041120HCID 67041120, compoundYield 88%

Procedure

The title compound was prepared (yield 88%) by the procedure of Example 385G, substituting the product of Example 447D for the product of Example 385F. 1H-NMR (300 MHz, DMSO-d6) δ ppm: 1.34 (d, J=7.0 Hz, 6H), 3.23 (septet, J=7.0 Hz, 1H), 5.60 (br-s, 2H), 6.05 (quintet, J=9.2 Hz, 1H), 6.63 (d, J=8.5 Hz, 2H), 6.86 (d, J=8.4 Hz, 1H), 7.12 (d, J=8.5 Hz, 2H), 7.36-7.47 (m, 3H), 7.60-7.71 (m, 2H), 7.64 (d, J=8.5 Hz, 1H), 7.75 (br-d, J=8.4 Hz, 1H), 7.95 (br-s, 1H), 8.57 (s, 1H), 8.87 (d, J=8.5 Hz, 1H), 9.42 (d, J=9.5 Hz, 1H), 10.16 (s, 1H) MS ESI+ m/z: 589 (M+H)

Sources & evidence

ORD record: ord-4a0ac14c918143d0a9d51837534811cb
Source dataset: uspto-grants-2011_03
DOI: 10.6084/m9.figshare.5104873.v1
Patent number: US07910595B2

Reaction notes

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