Sodium Hydroxide → {[(4-{4-[((2R)-2-Hydroxy-2-{4-hydroxy-3-[(methylsulfonyl)amino]phenyl}ethyl)amino]-1-piperidineyl}anilino)carbonyl]amino}acetic acid

HRID 1794924노트

반응식

[OH:1][C@H:2]([C:27]1[CH:32]=[CH:31][C:30]([OH:33])=[C:29]([NH:34][S:35]([CH3:38])(=[O:37])=[O:36])[CH:28]=1)[CH2:3][NH:4][CH:5]1[CH2:10][CH2:9][N:8]([C:11]2[CH:26]=[CH:25][C:14]([NH:15][C:16]([NH:18][CH2:19][C:20]([O:22]CC)=[O:21])=[O:17])=[CH:13][CH:12]=2)[CH2:7][CH2:6]1.[OH-].[Na+]>>[OH:1][C@H:2]([C:27]1[CH:32]=[CH:31][C:30]([OH:33])=[C:29]([NH:34][S:35]([CH3:38])(=[O:36])=[O:37])[CH:28]=1)[CH2:3][NH:4][CH:5]1[CH2:10][CH2:9][N:8]([C:11]2[CH:12]=[CH:13][C:14]([NH:15][C:16]([NH:18][CH2:19][C:20]([OH:22])=[O:21])=[O:17])=[CH:25][CH:26]=2)[CH2:7][CH2:6]1

참가 물질

반응물 2

HCID 14798Sodium Hydroxide

HCID 86584576Ethyl {[(4-{4-[((2R)-2-hydroxy-2-{4-hydroxy-3-[(methylsulfonyl)amino]phenyl}-ethyl)amino]-1-piperidineyl}anilino)carbonyl]amino}acetate

생성물 1

HCID 69654942{[(4-{4-[((2R)-2-Hydroxy-2-{4-hydroxy-3-[(methylsulfonyl)amino]phenyl}ethyl)amino]-1-piperidineyl}anilino)carbonyl]amino}acetic acid

실험 절차

The title compound was prepared from ethyl {[(4-{4-[((2R)-2-hydroxy-2-{4-hydroxy-3-[(methylsulfonyl)amino]phenyl}ethyl)amino]-1-piperidinyl}anilino)carbonyl]-amino}acetate (which was obtained in Example 377) by NaOH hydrolysis as a white solid; 1H NMR (300 MHz, DMSO-d6) δ 1.35–1.55 (m, 2 H), 1.80–2.00 (m, 2 H), 2.50–2.90 (m, 5 H), 2.92 (s, 3 H), 3.30–3.50 (m, 2 H), 3.59 (d, J=5.9 Hz, 2 H), 4.60 (dd, J=8.8, 3.5 Hz, 1 H), 6.14 (t, J=5.0 Hz, 1 H), 6.80 (d, J=9.1 Hz, 2 H), 6.84 (d, J=8.3 Hz, 1 H), 7.03 (dd, J=8.3, 2.0 Hz, 1 H), 7.15–7.25 (m, 3 H), 8.54 (s, 1 H); MS (ES) m/z: 520.3 (M−H)−; HRMS Calcd. for C23H32N5O7S (MH+): 522.2017. Found: 522.2000.

출처 및 근거

ORD 기록: ord-60e1cd93b8964fb78da60efd64944c1b
출처 데이터셋: uspto-grants-2006_04
DOI: 10.6084/m9.figshare.5104873.v1
특허 번호: US07022716B2

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