2-O-Desmethyl Cisapride

Base Information

Chemical Name:2-O-Desmethyl Cisapride
CAS No.:102671-04-5
Molecular Formula:C22H27 Cl F N3 O4
Molecular Weight:451.925
Hs Code.:
DSSTox Substance ID:DTXSID90907978
Nikkaji Number:J3.084.491B
Wikidata:Q82877314
Mol file:102671-04-5.mol

Synonyms:norcisapride

Suppliers and Price of 2-O-Desmethyl Cisapride

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
2-O-DesmethylCisapride
2mg
$ 110.00

TRC
2-O-DesmethylCisapride
5 mg
$ 140.00

Medical Isotopes, Inc.
Norcisapride
1 mg
$ 620.00

Biosynth Carbosynth
2-O-Desmethyl cisapride
50 mg
$ 1750.00

Biosynth Carbosynth
2-O-Desmethyl cisapride
25 mg
$ 1000.00

Biosynth Carbosynth
2-O-Desmethyl cisapride
10 mg
$ 462.50

Biosynth Carbosynth
2-O-Desmethyl cisapride
5 mg
$ 254.40

Biosynth Carbosynth
2-O-Desmethyl cisapride
2 mg
$ 139.90

Total 3 raw suppliers

Chemical Property of 2-O-Desmethyl Cisapride

Chemical Property:

Vapor Pressure:1.11E-08mmHg at 25°C
Boiling Point:612.1°Cat760mmHg
Flash Point:324°C
PSA：97.05000
Density:1.35g/cm³
LogP:3.96510
Storage Temp.:-20°C Freezer
Solubility.:DMSO (Slightly), Methanol (Slightly, Sonicated)
XLogP3:3.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:451.1674122
Heavy Atom Count:31
Complexity:567

Purity/Quality:

97% ^*data from raw suppliers

2-O-DesmethylCisapride ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:COC1CN(CCC1NC(=O)C2=CC(=C(C=C2O)N)Cl)CCCOC3=CC=C(C=C3)F
Isomeric SMILES:CO[C@H]1CN(CC[C@H]1NC(=O)C2=CC(=C(C=C2O)N)Cl)CCCOC3=CC=C(C=C3)F
Uses Minor Cisapride (C496400) metabolite.

Technology Process of 2-O-Desmethyl Cisapride

There total 1 articles about 2-O-Desmethyl Cisapride 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: 54.0%

: 81098-60-4,86718-68-5,86719-31-5,86719-33-7,104860-66-4,104860-73-3,86718-70-9
(+)-(3S,4R)-cisapride

: 102671-04-5
4-Amino-5-chloro-N-{(3S,4R)-1-[3-(4-fluoro-phenoxy)-propyl]-3-methoxy-piperidin-4-yl}-2-hydroxy-benzamide

Guidance literature:: With 2-methoxybenzamide; sodium hydride; ethanethiol; In N,N-dimethyl-formamide; trifluoroacetic acid; at 100 - 105 ℃; for 1.5h;
DOI:10.1016/0223-5234(89)90004-4

Reference yield: 76.0%

: 542-81-4
sulfure de methyle et de 2-chloroethyle

: 102671-04-5
4-Amino-5-chloro-N-{(3S,4R)-1-[3-(4-fluoro-phenoxy)-propyl]-3-methoxy-piperidin-4-yl}-2-hydroxy-benzamide

: 102671-13-6
4-Amino-5-chloro-N-{(3S,4R)-1-[3-(4-fluoro-phenoxy)-propyl]-3-methoxy-piperidin-4-yl}-2-(2-methylsulfanyl-ethoxy)-benzamide

Guidance literature:: With potassium carbonate; sodium iodide; In N,N-dimethyl-formamide; 1.) room temp., 16 h; 2.) 50 deg C, 2 h;
DOI:10.1016/0223-5234(89)90004-4

Reference yield:

: 102671-04-5
4-Amino-5-chloro-N-{(3S,4R)-1-[3-(4-fluoro-phenoxy)-propyl]-3-methoxy-piperidin-4-yl}-2-hydroxy-benzamide

: 125557-41-7
4-Amino-5-chloro-N-{(3S,4R)-1-[3-(4-fluoro-phenoxy)-propyl]-3-methoxy-piperidin-4-yl}-2-(2-methanesulfinyl-ethoxy)-benzamide

Guidance literature:: Multi-step reaction with 2 steps

1: 76 percent / K₂CO₃, NaI / dimethylformamide / 1.) room temp., 16 h; 2.) 50 deg C, 2 h

2: 35 percent / 2 N HCl, NaIO₄ / H₂O / 2 h

With hydrogenchloride; sodium periodate; potassium carbonate; sodium iodide; In water; N,N-dimethyl-formamide;
DOI:10.1016/0223-5234(89)90004-4