Hydrochloric Acid → N-{2-[5-Chloro-2-(3-oxo-2,3,4,5-tetrahydro-1H-benzo[e][1,3]diazepin-7-ylamino)-pyrimidin-4-ylamino]-phenyl}-methanesulfonamide

HRID 827788Notes

Reaction equation

HRID 827788 reaction equation
[CH:42]([OH:43])([CH3:44])[CH3:45].[Cl:14][c:15]1[n:16][cH:17][c:18]([Cl:33])[c:19]([NH:21][c:22]2[c:23]([NH:28][S:29](=[O:30])(=[O:31])[CH3:32])[cH:24][cH:25][cH:26][cH:27]2)[n:20]1.[ClH:34].[ClH:41].[NH2:1][c:2]1[cH:3][c:4]2[c:5]([cH:12][cH:13]1)[CH2:6][NH:7][C:8](=[O:11])[NH:9][CH2:10]2.[O:35]1[CH2:36][CH2:37][O:38][CH2:39][CH2:40]1>>[NH:1]([c:2]1[cH:3][c:4]2[c:5]([cH:12][cH:13]1)[CH2:6][NH:7][C:8](=[O:11])[NH:9][CH2:10]2)[c:15]1[n:16][cH:17][c:18]([Cl:33])[c:19]([NH:21][c:22]2[c:23]([NH:28][S:29](=[O:30])(=[O:31])[CH3:32])[cH:24][cH:25][cH:26][cH:27]2)[n:20]1

Participants

6

Reactant 5

HCID 313Hydrochloric Acid2×HCID 3776IsopropanolHCID 312751,4-DioxaneHCID 578538687-Amino-1,2,4,5-tetrahydro-(2,4)-benzodiazepin-3-oneHCID 58236399HCID 58236399, compound

Product 1

HCID 66830023N-{2-[5-Chloro-2-(3-oxo-2,3,4,5-tetrahydro-1H-benzo[e][1,3]diazepin-7-ylamino)-pyrimidin-4-ylamino]-phenyl}-methanesulfonamide

Sources & evidence

ORD record
ord-a31c5f2d4ec240398b744306b342926f
Source dataset
Test data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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