1-[2-[4-(4-chlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-3-cyclohexyl-1-(2-methylpropyl)urea

Base Information

• Chemical Name: 1-[2-[4-(4-chlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-3-cyclohexyl-1-(2-methylpropyl)urea
• CAS No.: 5957-64-2
• Molecular Formula: C₁₅H₂₄
• Molecular Weight: 204.356
• DSSTox Substance ID: DTXSID20412186

Synonyms:5957-64-2;1-[2-[4-(4-chlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-3-cyclohexyl-1-(2-methylpropyl)urea;DTXSID20412186

Chemical Property of 1-[2-[4-(4-chlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-3-cyclohexyl-1-(2-methylpropyl)urea

Chemical Property:

• Vapor Pressure: 7.79E-19mmHg at 25°C
• Boiling Point: 689°Cat760mmHg
• Flash Point: 370.5°C
• Density: 1.25g/cm³
• XLogP3: 5.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 487.2060262
• Heavy Atom Count: 33
• Complexity: 664

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)CN(CC(=O)N1CCC2=C(C1C3=CC=C(C=C3)Cl)C=CS2)C(=O)NC4CCCCC4

Technology Process of 1-[2-[4-(4-chlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-3-cyclohexyl-1-(2-methylpropyl)urea

There total 4 articles about 1-[2-[4-(4-chlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-3-cyclohexyl-1-(2-methylpropyl)urea 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:

(8R,8aR)-2-Isopropylidene-8,8a-dimethyl-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-one → (+/-)-4-epi-Δ1(10)-Aristolen (5957-64-2,17334-55-3,19912-82-4,20501-51-3,28967-19-3,28967-23-9,28967-24-0,79433-67-3)

Guidance literature:

Multistep reaction; (i) N₂H₄*H₂O, (ii) KOH, (heating);

DOI:10.1021/ja00722a019

Reference yield:

(8S,8aR)-2-Isopropylidene-8,8a-dimethyl-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-one → (+/-)-Δ1(10)-Aristolen (5957-64-2,17334-55-3,19912-82-4,20501-51-3,28967-19-3,28967-23-9,28967-24-0,79433-67-3)

Guidance literature:

Multistep reaction; (i) N₂H₄*H₂O, (ii) KOH;

DOI:10.1021/ja00722a019

Reference yield:

(8S,8aR)-8,8a-Dimethyl-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-one → (+/-)-Δ1(10)-Aristolen (5957-64-2,17334-55-3,19912-82-4,20501-51-3,28967-19-3,28967-23-9,28967-24-0,79433-67-3)

Guidance literature:

Multi-step reaction with 2 steps

1: (i) NaH, (ii) /BRN= 3587162/, (iii) aq. HCl

2: (i) N₂H₄*H₂O, (ii) KOH

DOI:10.1021/ja00722a019

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