4'-Hydroxycilostazol, trans-

Base Information

• Chemical Name: 4'-Hydroxycilostazol, trans-
• CAS No.: 87153-06-8
• Molecular Formula: C20H27N5O3
• Molecular Weight: 385.466
• UNII: 142MZU1X6Q,HL83KWZ4LH
• DSSTox Substance ID: DTXSID30434374,DTXSID801343144
• Nikkaji Number: J1.030.671J,J1.030.672H
• Wikidata: Q27279982
• Mol file: 87153-06-8.mol

Synonyms:4'-hydroxycilostazol, trans-;4'-trans-hydroxy cilostazol;OPC-13213

Chemical Property of 4'-Hydroxycilostazol, trans-

Chemical Property:

• PSA: 102.16000
• LogP: 2.57350
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 385.21138974
• Heavy Atom Count: 28
• Complexity: 514

Purity/Quality:

95% ^*data from raw suppliers

OPC-13217, 4 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC(CCC1N2C(=NN=N2)CCCCOC3=CC4=C(C=C3)NC(=O)CC4)O

Technology Process of 4'-Hydroxycilostazol, trans-

There total 4 articles about 4'-Hydroxycilostazol, trans- 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: 88.0%

6-{4-[1-(4-Benzyloxy-cyclohexyl)-1H-tetrazol-5-yl]-butoxy}-3,4-dihydro-1H-quinolin-2-one (87152-99-6) → OPC 13217 (87153-06-8)

Guidance literature:

With hydrogen; palladium on activated charcoal; In methanol; acetic acid; at 60 - 70 ℃; for 8h; under 1140 - 1520 Torr;

DOI:10.1248/cpb.33.1140

Reference yield:

3,4-dihydro-6-hydroxy-2(1H)-quinolinone (54197-66-9) → OPC 13217 (87153-06-8)

Guidance literature:

Multi-step reaction with 2 steps

1: 66 percent / aq.85percent KOH / propan-2-ol / 18 h / Heating

2: 88 percent / hydrogen / 10percent Pd-C / methanol; acetic acid / 8 h / 60 - 70 °C / 1140 - 1520 Torr

With potassium hydroxide; hydrogen; palladium on activated charcoal; In methanol; acetic acid; isopropyl alcohol;

DOI:10.1248/cpb.33.1140

Reference yield:

1-(4-Benzyloxy-cyclohexyl)-5-(4-chloro-butyl)-1H-tetrazole (98454-49-0) → OPC 13217 (87153-06-8)

Guidance literature:

Multi-step reaction with 2 steps

1: 66 percent / aq.85percent KOH / propan-2-ol / 18 h / Heating

2: 88 percent / hydrogen / 10percent Pd-C / methanol; acetic acid / 8 h / 60 - 70 °C / 1140 - 1520 Torr

With potassium hydroxide; hydrogen; palladium on activated charcoal; In methanol; acetic acid; isopropyl alcohol;

DOI:10.1248/cpb.33.1140

upstream raw materials:

6-[4-(1-cyclohexyl-1H-tetrazol-5-yl)butoxy]-3,4-dihydrocarbostyril

6-{4-[1-(4-Benzyloxy-cyclohexyl)-1H-tetrazol-5-yl]-butoxy}-3,4-dihydro-1H-quinolin-2-one

3,4-dihydro-6-hydroxy-2(1H)-quinolinone

1-(4-Benzyloxy-cyclohexyl)-5-(4-chloro-butyl)-1H-tetrazole