8-((3-(4-(1,2-Benzisothiazol-3-yl)-1-piperazinyl)propyl)oxy)-8-azaspiro(4.5)decane-7,9-dione

Base Information

Chemical Name:8-((3-(4-(1,2-Benzisothiazol-3-yl)-1-piperazinyl)propyl)oxy)-8-azaspiro(4.5)decane-7,9-dione
CAS No.:118856-18-1
Molecular Formula:C₂₃H₃₀N₄O₃S*ClH
Molecular Weight:479.043
Hs Code.:
DSSTox Substance ID:DTXSID20922795
Mol file:118856-18-1.mol

Synonyms:8-((3-(4-(1,2-benzisothiazol-3-yl)-1-piperazinyl)propyl)oxy)-8-azaspiro(4.5)decane-7,9-dione;8-BPPA

Suppliers and Price of 8-((3-(4-(1,2-Benzisothiazol-3-yl)-1-piperazinyl)propyl)oxy)-8-azaspiro(4.5)decane-7,9-dione

Supply Marketing:

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

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Chemical Property of 8-((3-(4-(1,2-Benzisothiazol-3-yl)-1-piperazinyl)propyl)oxy)-8-azaspiro(4.5)decane-7,9-dione

Chemical Property:

Vapor Pressure:1.02E-12mmHg at 25°C
Boiling Point:563.4°Cat760mmHg
Flash Point:294.5°C
PSA：94.22000
Density:g/cm³
LogP:3.39020
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:478.1805397
Heavy Atom Count:32
Complexity:643

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CCC2(C1)CC(=O)N(C(=O)C2)OCCCN3CCN(CC3)C4=NSC5=CC=CC=C54.Cl

Technology Process of 8-((3-(4-(1,2-Benzisothiazol-3-yl)-1-piperazinyl)propyl)oxy)-8-azaspiro(4.5)decane-7,9-dione

There total 3 articles about 8-((3-(4-(1,2-Benzisothiazol-3-yl)-1-piperazinyl)propyl)oxy)-8-azaspiro(4.5)decane-7,9-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:

: 87691-87-0
3-(1-piperazinyl)-1,2-benzisothiazole

: 118856-22-7
N-[(3-bromopropyl)oxy]-8-azaspiro[4.5]decane-7,9-dione

: 118856-18-1
8-<<3-<4-(1,2-benzisothiazol-3-yl)-1-piperazinyl>propyl>oxy>-8-azaspiro<4.5>decane-7,9-dione hydrochloride

Guidance literature:: With potassium carbonate; sodium iodide; In acetonitrile; at 80 ℃; for 18h;
DOI:10.1021/jm00107a028

Reference yield:

: 64744-43-0
8-hydroxy-8-azaspiro<4.5>decane-7,9-dione

: 118856-18-1
8-<<3-<4-(1,2-benzisothiazol-3-yl)-1-piperazinyl>propyl>oxy>-8-azaspiro<4.5>decane-7,9-dione hydrochloride

Guidance literature:: Multi-step reaction with 2 steps

1: 3.7 g / K₂CO₃, NaI / acetonitrile / 6 h / 80 °C

2: 3.42 g / K₂CO₃, NaI / acetonitrile / 18 h / 80 °C

With potassium carbonate; sodium iodide; In acetonitrile;
DOI:10.1021/jm00107a028

Reference yield:

: 5662-95-3
3,3-tetramethylene glutaric anhydride

: 118856-18-1
8-<<3-<4-(1,2-benzisothiazol-3-yl)-1-piperazinyl>propyl>oxy>-8-azaspiro<4.5>decane-7,9-dione hydrochloride

Guidance literature:: Multi-step reaction with 3 steps

1: 3.2 g / hydroxylamine hydrochloride, pyridine / 18 h / 80 °C

2: 3.7 g / K₂CO₃, NaI / acetonitrile / 6 h / 80 °C

3: 3.42 g / K₂CO₃, NaI / acetonitrile / 18 h / 80 °C

With pyridine; hydroxylamine hydrochloride; potassium carbonate; sodium iodide; In acetonitrile;
DOI:10.1021/jm00107a028