HCID 67040380, compound → HCID 67040575, compound

HRID 605415Notes

Reaction equation

[C@H:1]1([NH:10][C:11]([C:13]2[CH:18]=[CH:17][C:16]([S:19][C:20]3[CH:25]=[CH:24][C:23]([NH:26]C(=O)OC(C)(C)C)=[CH:22][CH:21]=3)=[C:15]([NH:34][C:35]3[C:36]4[CH:44]=[CH:43][C:42]([CH:45]([CH3:47])[CH3:46])=[N:41][C:37]=4[N:38]=[CH:39][N:40]=3)[CH:14]=2)=[O:12])[C:9]2[C:4](=[CH:5][CH:6]=[CH:7][CH:8]=2)[CH2:3][CH2:2]1.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>>[NH2:26][C:23]1[CH:24]=[CH:25][C:20]([S:19][C:16]2[CH:17]=[CH:18][C:13]([C:11]([NH:10][C@H:1]3[C:9]4[C:4](=[CH:5][CH:6]=[CH:7][CH:8]=4)[CH2:3][CH2:2]3)=[O:12])=[CH:14][C:15]=2[NH:34][C:35]2[C:36]3[CH:44]=[CH:43][C:42]([CH:45]([CH3:47])[CH3:46])=[N:41][C:37]=3[N:38]=[CH:39][N:40]=2)=[CH:21][CH:22]=1

Participants

Reactant 2

HCID 67040380HCID 67040380, compound

HCID 71655448HCID 71655448, compound

Product 1

HCID 67040575HCID 67040575, compoundYield 89%

Procedure

The title compound was prepared (yield 89%) by the procedure in Example 385G substituting the product of Example 446A for the product of Example 385F. 1H-NMR (300 MHz, DMSO-d6) δ ppm: 1.33 (d, J=7.0 Hz, 6H), 1.86-2.04 (m, 1H), 2.33-2.53 (m, 1H), 2.74-3.03 (m, 2H), 3.22 (septet, J=7.0 Hz, 1H), 5.48-5.62 (m, 1H), 5.58 (s, 2H), 6.62 (d, J=8.5 Hz, 2H), 6.83 (d, J=8.1 Hz, 1H), 7.11-7.28 (m, 4H), 7.13 (d, J=8.5 Hz, 2H), 7.63 (d, J=8.5 Hz, 1H), 7.75 (dd, J=8.1, 1.5 Hz, 1H), 7.90 (d, J=1.5 Hz, 1H), 8.56 (s, 1H), 8.73 (d, J=8.1 Hz, 1H), 8.86 (d, J=8.5 Hz, 1H), 10.11 (s, 1H) MS ESI+ m/z: 547 (M+H), ESI− m/z: 545 (M−H)

Sources & evidence

ORD record: ord-1e973210796849478e68649fcf9a3571
Source dataset: uspto-grants-2011_03
DOI: 10.6084/m9.figshare.5104873.v1
Patent number: US07910595B2

Reaction notes

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