Dichloromethane → 3-Amino-5-(cyclopropylmethyl)-2-phenyl-2,3-dihydro-1,5-benzoxazepin-4-one

HRID 98856Notes

Reaction equation

HRID 98856 reaction equation
[CH:1]1([CH2:4][N:5]2[C:6](=[O:30])[CH:7]([NH:22][C:23](=[O:24])[O:25][C:26]([CH3:27])([CH3:28])[CH3:29])[CH:8]([c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)[O:9][c:10]3[c:11]2[cH:12][cH:13][cH:14][cH:15]3)[CH2:2][CH2:3]1.[Cl:38][CH2:39][Cl:40].[OH:31][C:32]([C:33]([F:34])([F:35])[F:36])=[O:37]>>[CH:1]1([CH2:4][N:5]2[C:6](=[O:30])[CH:7]([NH2:22])[CH:8]([c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)[O:9][c:10]3[c:11]2[cH:12][cH:13][cH:14][cH:15]3)[CH2:2][CH2:3]1

Participants

4

Reactant 3

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 178452930HCID 178452930, compound

Product 1

HCID 686304073-Amino-5-(cyclopropylmethyl)-2-phenyl-2,3-dihydro-1,5-benzoxazepin-4-one

Sources & evidence

ORD record
ord-7decd082ad774fedbeeef9e401a63579
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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