Sarmazenil

Base Information

Chemical Name:Sarmazenil
CAS No.:78771-13-8
Molecular Formula:C15H14ClN3O3
Molecular Weight:319.747
Hs Code.:
UNII:F84AE7X24P
DSSTox Substance ID:DTXSID70229281
Nikkaji Number:J344.582H
Wikipedia:Sarmazenil
Wikidata:Q7424290
NCI Thesaurus Code:C73206
ChEMBL ID:CHEMBL46547
Mol file:78771-13-8.mol

Synonyms:sarmazenil

Suppliers and Price of Sarmazenil

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

TRC
Sarmazenil
1mg
$ 235.00

American Custom Chemicals Corporation
SARMAZENIL 95.00%
5MG
$ 495.06

Total 5 raw suppliers

Chemical Property of Sarmazenil

Chemical Property:

Vapor Pressure:2.57E-12mmHg at 25°C
Melting Point:224 °C
Boiling Point:554°Cat760mmHg
PKA:0.70±0.20(Predicted)
Flash Point:288.9°C
PSA：64.43000
Density:1.43g/cm³
LogP:2.22590
XLogP3:1.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:319.0723690
Heavy Atom Count:22
Complexity:461

Purity/Quality:

≥95% ^*data from raw suppliers

Sarmazenil ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)C1=C2CN(C(=O)C3=C(N2C=N1)C=CC=C3Cl)C
Uses Sarmazenil is a benzodiazepine receptor antagonist.

Technology Process of Sarmazenil

There total 1 articles about Sarmazenil 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:

: 3400-09-7
dichloroamine

: ethyl(dimethylamino-methylenamino)acetate

: 78755-99-4
3,4-dihydro-4-methyl-6-chloro-2H-1,4-benzodiazepine-2,5(1H)-dione

: 99-97-8
Dimethyl-p-toluidine

: 78771-13-8
ethyl 7-chloro-5-methyl-6-oxo-5,6-dihydro-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate

Guidance literature:: With n-butyllithium; acetic acid; 1,1,1,3,3,3-hexamethyl-disilazane; trichlorophosphate; In tetrahydrofuran; n-heptane; water; toluene;

Reference yield:

: 78771-13-8
ethyl 7-chloro-5-methyl-6-oxo-5,6-dihydro-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate

: cyclohexyl 7-chloro-5,6-dihydro-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate

Guidance literature:: In chloroform; cyclohexanol;

Reference yield:

: 78771-13-8
ethyl 7-chloro-5-methyl-6-oxo-5,6-dihydro-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate

: 122384-14-9
L-663581

Guidance literature:: Multi-step reaction with 5 steps

1: 84 percent / 2 N NaOH / methanol / 1 h

2: 1) Et₃N, ethyl chloroformate, 2) NH₃ / 1) CH₂Cl₂, 15 to 20 deg C, 1 h

3: 70 percent / pyridine, trifluoroacetic anhydride / dioxane / 16 h / 20 °C

4: NH₂OH*HCl, K₂CO₃ / ethanol; H₂O / 1 h / Heating

5: 160 °C

With pyridine; sodium hydroxide; hydroxylamine hydrochloride; ammonia; chloroformic acid ethyl ester; potassium carbonate; triethylamine; trifluoroacetic anhydride; In 1,4-dioxane; methanol; ethanol; water;
DOI:10.1021/jm00130a010