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102-07-8,MFCD00003017
Catalog No.:AA00065F
102-07-8 | 1,3-Diphenylurea
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5g
98%
in stock  
$14.00   $10.00
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25g
98%
in stock  
$22.00   $15.00
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100g
98%
in stock  
$57.00   $40.00
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500g
98%
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$215.00   $150.00
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  • Technical Information
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  • Technical Information
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Technical Information
Catalog Number:
AA00065F
Chemical Name:
1,3-Diphenylurea
CAS Number:
102-07-8
Molecular Formula:
C13H12N2O
Molecular Weight:
212.2472
MDL Number:
MFCD00003017
IUPAC Name:
1,3-diphenylurea
InChI:
InChI=1S/C13H12N2O/c16-13(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h1-10H,(H2,14,15,16)
InChI Key:
GWEHVDNNLFDJLR-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccccc1)Nc1ccccc1
EC Number:
203-003-7
UNII:
94YD8RMX5B
Properties
Computed Properties
 
Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.095g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
212.252g/mol
Monoisotopic Mass:
212.095g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

Literature

Title: Simultaneous determination of triclosan, triclocarban, and transformation products of triclocarban in aqueous samples using solid-phase micro-extraction-HPLC-MS/MS.

Journal: Journal of separation science 20121001

Title: Analysis of the infrared and Raman spectra of the symmetrically substituted 1,3-diphenylurea and 1,3-diphenylacetone (dibenzyl ketone).

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20120901

Title: Current advances in detection and treatment of babesiosis.

Journal: Current medicinal chemistry 20120401

Title: Fate of triclosan and triclocarban in soil columns with and without biosolids surface application.

Journal: Environmental toxicology and chemistry 20120201

Title: Identification of trans-4-[1-[[7-fluoro-2-(1-methyl-3-indolyl)-6-benzoxazolyl]acetyl]-(4S)-fluoro-(2S)-pyrrolidinylmethoxy]cyclohexanecarboxylic acid as a potent, orally active VLA-4 antagonist.

Journal: Bioorganic & medicinal chemistry 20120201

Title: Brain insulin resistance and deficiency as therapeutic targets in Alzheimer's disease.

Journal: Current Alzheimer research 20120101

Title: Carbonylation of nitrobenzene in methanol with palladium bidentate phosphane complexes: an unexpectedly complex network of catalytic reactions, centred around a Pd-imido intermediate.

Journal: Chemistry (Weinheim an der Bergstrasse, Germany) 20111118

Title: The structure-activity relationship of urea derivatives as anti-tuberculosis agents.

Journal: Bioorganic & medicinal chemistry 20110915

Title: Selectivity of kinase inhibitor fragments.

Journal: Journal of medicinal chemistry 20110728

Title: Evaluation of mass spectrometric methods for detection of the anti-protozoal drug imidocarb.

Journal: Journal of analytical toxicology 20110501

Title: Identification of wastewater bacteria involved in the degradation of triclocarban and its non-chlorinated congener.

Journal: Journal of hazardous materials 20101115

Title: Dual-target-directed 1,3-diphenylurea derivatives: BACE 1 inhibitor and metal chelator against Alzheimer's disease.

Journal: Bioorganic & medicinal chemistry 20100801

Title: Cytokinin-induced structural adaptability of a Lupinus luteus PR-10 protein.

Journal: The FEBS journal 20090301

Title: Synthesis and evaluation of fluoroquinolone derivatives as substrate-based inhibitors of bacterial efflux pumps.

Journal: European journal of medicinal chemistry 20081101

Title: In vitro biologic activities of the antimicrobials triclocarban, its analogs, and triclosan in bioassay screens: receptor-based bioassay screens.

Journal: Environmental health perspectives 20080901

Title: Fate of triclosan and evidence for reductive dechlorination of triclocarban in estuarine sediments.

Journal: Environmental science & technology 20080615

Title: 3,3'-Diphenyl-1,1'-[2,2'-oxybis(2,1-phenyl-ene)]diurea N,N-dimethyl-formamide disolvate.

Journal: Acta crystallographica. Section E, Structure reports online 20080101

Title: The RET kinase inhibitor NVP-AST487 blocks growth and calcitonin gene expression through distinct mechanisms in medullary thyroid cancer cells.

Journal: Cancer research 20070715

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

Title: Electrochemically controlled hydrogen bonding. Redox-dependent formation of a 2:1 diarylurea/dinitrobenzene2- complex.

Journal: The Journal of organic chemistry 20051223

Title: Electrochemically controlled hydrogen bonding. Nitrobenzenes as simple redox-dependent receptors for arylureas.

Journal: Journal of the American Chemical Society 20050504

Title: Inhibition of neuronal Na+ channels by the novel antiepileptic compound DCUKA: identification of the diphenylureido moiety as an inactivation modifier.

Journal: Experimental neurology 20021101

Title: Metabolism of diphenylurea by a Marinobacter sp. isolated from a contaminated ephemeral stream bed in the Negev Desert.

Journal: FEMS microbiology letters 20020806

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