Piperidine, 1-((4-amino-2,3-dihydro-3-(4-methylphenyl)-2-thioxo-5-thiazolyl)carbonyl)-

Base Information

• Chemical Name: Piperidine, 1-((4-amino-2,3-dihydro-3-(4-methylphenyl)-2-thioxo-5-thiazolyl)carbonyl)-
• CAS No.: 57037-02-2
• Molecular Formula: C₁₆H₁₉N₃OS₂
• Molecular Weight: 333.478
• Hs Code.: 2934100090
• DSSTox Substance ID: DTXSID40205653
• Wikidata: Q83079265
• ChEMBL ID: CHEMBL1455260
• Mol file: 57037-02-2.mol

Synonyms:BRN 1222534;Piperidine, 1-((4-amino-2,3-dihydro-3-(4-methylphenyl)-2-thioxo-5-thiazolyl)carbonyl)-;MLS000088168;57037-02-2;SMR000072403;1-((4-Amino-2,3-dihydro-3-(4-methylphenyl)-2-thioxo-5-thiazolyl)carbonyl)piperidine;4-amino-3-(4-methylphenyl)-5-(1-piperidinylcarbonyl)-1,3-thiazole-2(3H)-thione;Oprea1_559033;CHEMBL1455260;BDBM34409;cid_2187510;DTXSID40205653;HMS2425O22;STK877256;AKOS000347868;[4-amino-3-(4-methylphenyl)-2-sulfanylidene-1,3-thiazol-5-yl]-piperidin-1-ylmethanone;LS-114196;MLS-0030860.0001;SR-01000260987;SR-01000260987-1;Z204242734;[4-amino-3-(p-tolyl)-2-thioxo-4-thiazolin-5-yl]-piperidino-methanone;[4-amino-3-(4-methylphenyl)-2-sulfanylidene-5-thiazolyl]-(1-piperidinyl)methanone;[4-azanyl-3-(4-methylphenyl)-2-sulfanylidene-1,3-thiazol-5-yl]-piperidin-1-yl-methanone;4-amino-3-(4-methylphenyl)-5-(piperidin-1-ylcarbonyl)-1,3-thiazole-2(3H)-thione;[4-amino-3-(4-methylphenyl)-2-thioxo-2,3-dihydro-1,3-thiazol-5-yl](piperidin-1-yl)methanone

Chemical Property of Piperidine, 1-((4-amino-2,3-dihydro-3-(4-methylphenyl)-2-thioxo-5-thiazolyl)carbonyl)-

Chemical Property:

• Vapor Pressure: 1.3E-10mmHg at 25°C
• Boiling Point: 512.4°Cat760mmHg
• Flash Point: 263.7°C
• PSA: 111.59000
• Density: 1.37g/cm³
• LogP: 4.30410
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 333.09695459
• Heavy Atom Count: 22
• Complexity: 492

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)N2C(=C(SC2=S)C(=O)N3CCCCC3)N

Technology Process of Piperidine, 1-((4-amino-2,3-dihydro-3-(4-methylphenyl)-2-thioxo-5-thiazolyl)carbonyl)-

There total 1 articles about Piperidine, 1-((4-amino-2,3-dihydro-3-(4-methylphenyl)-2-thioxo-5-thiazolyl)carbonyl)- 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:

1-cyanoacetylpiperidine (15029-30-8) + 1-isothiocyanato-4-methylbenzene (622-59-3) → 1-(4-amino-2-thioxo-3-p-tolyl-2,3-dihydro-thiazole-5-carbonyl)-piperidine (57037-02-2)

Guidance literature:

With sulfur; triethylamine; In N,N-dimethyl-formamide;

upstream raw materials:

1-cyanoacetylpiperidine

1-isothiocyanato-4-methylbenzene