1-(4-Methoxybenzyl)-3,4-dihydro-1H-benzo[e][1,4]diazepine-2,5-dione

Base Information

Chemical Name:1-(4-Methoxybenzyl)-3,4-dihydro-1H-benzo[e][1,4]diazepine-2,5-dione
CAS No.:169504-53-4
Molecular Formula:C17H16N2O3
Molecular Weight:296.326
Hs Code.:2933990090
DSSTox Substance ID:DTXSID50391652
Wikidata:Q72465467
Mol file:169504-53-4.mol

Synonyms:169504-53-4;1-(4-Methoxybenzyl)-3,4-dihydro-1H-benzo[e][1,4]diazepine-2,5-dione;1-[(4-methoxyphenyl)methyl]-3,4-dihydro-1,4-benzodiazepine-2,5-dione;3,4-dihydro-1-[(4-methoxyphenyl)methyl]-1H-1,4-Benzodiazepine-2,5-dione;SCHEMBL6525579;DTXSID50391652;QRZQNJZWXRBEOV-UHFFFAOYSA-N;AMY22664;AKOS002751997;1-[(4-methoxyphenyl)methyl]-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine-2,5-dione

Suppliers and Price of 1-(4-Methoxybenzyl)-3,4-dihydro-1H-benzo[e][1,4]diazepine-2,5-dione

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Alichem
1-(4-Methoxybenzyl)-3,4-dihydro-1H-benzo[e][1,4]diazepine-2,5-dione
1g
$ 690.80

American Custom Chemicals Corporation
1-(4-METHOXYBENZYL)-3,4-DIHYDRO-1H-BENZO[E][1,4]DIAZEPINE-2,5-DIONE 95.00%
5MG
$ 503.20

Chemenu
1-(4-methoxybenzyl)-3,4-dihydro-1H-benzo[e][1,4]diazepine-2,5-dione 95%
1g
$ 729.00

Crysdot
1-(4-Methoxybenzyl)-3,4-dihydro-1H-benzo[e][1,4]diazepine-2,5-dione 95+%
1g
$ 772.00

Total 12 raw suppliers

Chemical Property of 1-(4-Methoxybenzyl)-3,4-dihydro-1H-benzo[e][1,4]diazepine-2,5-dione

Chemical Property:

PSA：62.13000
Density:1.253
LogP:2.04720
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:296.11609238
Heavy Atom Count:22
Complexity:418

Purity/Quality:

98%min ^*data from raw suppliers

1-(4-Methoxybenzyl)-3,4-dihydro-1H-benzo[e][1,4]diazepine-2,5-dione ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=CC=C(C=C1)CN2C(=O)CNC(=O)C3=CC=CC=C32

Technology Process of 1-(4-Methoxybenzyl)-3,4-dihydro-1H-benzo[e][1,4]diazepine-2,5-dione

There total 5 articles about 1-(4-Methoxybenzyl)-3,4-dihydro-1H-benzo[e][1,4]diazepine-2,5-dione which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 97.0%

: 16512-74-6
1-(4-methoxybenzyl)-2H-benzo[d][1,3]oxazine-2,4(1H)-dione

: 56-40-6,18875-39-3,25718-94-9
glycine

: 169504-53-4
1-(4-ethoxy-benzyl)-3,4-dihydro-1H-benzo[e][1,4]diazepine-2,5-dione

Guidance literature:: With acetic acid; at 92 ℃; for 24h; Industry scale; Inert atmosphere;

Reference yield: 69.0%

: 5118-94-5
1,4-benzodiazepine-2,5-dione

: 824-94-2
p-methoxybenzyl chloride

: 169504-53-4
1-(4-ethoxy-benzyl)-3,4-dihydro-1H-benzo[e][1,4]diazepine-2,5-dione

Guidance literature:: With caesium carbonate; In N,N-dimethyl-formamide; at 20 ℃;
DOI:10.1021/jo026860a

Reference yield:

: 123-11-5
4-methoxy-benzaldehyde

: 169504-53-4
1-(4-ethoxy-benzyl)-3,4-dihydro-1H-benzo[e][1,4]diazepine-2,5-dione

Guidance literature:: Multi-step reaction with 3 steps

1.1: acetic acid / dichloromethane / 0.5 h / 40 °C / Industry scale; Inert atmosphere

1.2: 5 °C

2.1: tetrahydrofuran / 16 h / 15 - 20 °C

3.1: acetic acid / 24 h / 92 °C / Industry scale; Inert atmosphere

With acetic acid; In tetrahydrofuran; dichloromethane;