1-(4-Antipyryl)-3-(morpholino)-2-thiourea

Base Information

• Chemical Name: 1-(4-Antipyryl)-3-(morpholino)-2-thiourea
• CAS No.: 73791-36-3
• Molecular Formula: C₁₆H₂₀N₄O₂S
• Molecular Weight: 332.426
• DSSTox Substance ID: DTXSID30994766
• Nikkaji Number: J1.427.320D
• ChEMBL ID: CHEMBL597660

Synonyms:1-(4-Antipyryl)-3-(morpholino)-2-thiourea;73791-36-3;GNF-Pf-651;4-(Morpholinoethiocarbonylamino)antipyrine;ANTIPYRINE, 4-(MORPHOLINOTHIOCARBONYLAMINO)-;BRN 0045929;n-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1h-pyrazol-4-yl)morpholine-4-carbothioamide;CHEMBL597660;DTXSID30994766;QCTFIPXPNUSWCO-UHFFFAOYSA-N;AKOS000267297;N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)morpholine-4-carbothioamide;AB00091435-01;4-27-00-00306 (Beilstein Handbook Reference);SR-01000473872;SR-01000473872-1;F0856-0009;N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-4-morpholinecarbothioamide #;N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)morpholine-4-carboximidothioic acid

Chemical Property of 1-(4-Antipyryl)-3-(morpholino)-2-thiourea

Chemical Property:

• Vapor Pressure: 2.36E-08mmHg at 25°C
• Boiling Point: 451.8°C at 760 mmHg
• Flash Point: 227.1°C
• Density: 1.35g/cm³
• XLogP3: 0.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 332.13069707
• Heavy Atom Count: 23
• Complexity: 510

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=S)N3CCOCC3

Technology Process of 1-(4-Antipyryl)-3-(morpholino)-2-thiourea

There total 3 articles about 1-(4-Antipyryl)-3-(morpholino)-2-thiourea 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:

4-amino-2,3-dimethyl-1-phenylpyrazolin-5-one (83-07-8) → <5-Oxo-2,3-dimethyl-1-phenyl-Δ3-pyrazolinyl-(4)>-thiocarbamidsaeure-morpholid (73791-36-3)

Guidance literature:

Multi-step reaction with 2 steps

1: CHCl₃

2: methanol

With methanol; chloroform;

Reference yield:

morpholine (110-91-8,99108-56-2) + 4-isothiocyanato-2,3-dimethyl-1-phenyl-1,2-dihydropyrazol-5-one (91397-03-4) → <5-Oxo-2,3-dimethyl-1-phenyl-Δ3-pyrazolinyl-(4)>-thiocarbamidsaeure-morpholid (73791-36-3)

Guidance literature:

With methanol;

Reference yield:

→ <5-Oxo-2,3-dimethyl-1-phenyl-Δ3-pyrazolinyl-(4)>-thiocarbamidsaeure-morpholid (73791-36-3)

Guidance literature:

4-Isothiocyanato-2,3-dimethyl-1-phenyl-5-pyrazolon, Morpholin, EtOH, Δ;

DOI:10.1002/jps.2600530107

upstream raw materials:

morpholine

4-isothiocyanato-2,3-dimethyl-1-phenyl-1,2-dihydropyrazol-5-one

4-amino-2,3-dimethyl-1-phenylpyrazolin-5-one

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