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20503-88-2

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Basic Information
CAS No.: 20503-88-2
Name: 1-(4,5-diphenyl-1,3-oxazol-2-yl)-4-methyl-piperazine
Article Data: 1
Molecular Structure:
Molecular Structure of 20503-88-2 (1-(4,5-diphenyl-1,3-oxazol-2-yl)-4-methyl-piperazine)
Formula: C20H21N3O
Molecular Weight: 319.406
Synonyms: 1-(4,5-Diphenyl-1,3-oxazol-2-yl)-4-methylpiperazine;
Density: 1.143 g/cm3
Boiling Point: 451.8 °C at 760 mmHg
Flash Point: 227 °C
PSA: 32.51000
LogP: 3.76330
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  • Piperazine, 1-(4,5-diphenyl-2-oxazolyl)-4-methyl-

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    20503-88-2

    Piperazine, 1-(4,5-diphenyl-2-oxazolyl)-4-methyl-

    Min.Order: 10 Gram

    FOB Price:  USD $ 0.0-0.0

    Zibo Hangyu Biotechnology Development Co., Ltd is a leading manufacturer and supplier of chemicals in China. We develop produce and distribute high quality pharmaceuticals, intermediates, special chemicals and OLED intermediates and other fine chemi

    Hangyu Biotech is a leading manufacturer and supplier of chemicals in China. We develop produce and distribute high quality pharmaceuticals, intermediates, special chemicals and O

  •  Zibo Hangyu Biotechnology Development Co., Ltd

    China (Mainland)  |  Contact Details

    Business Type:Lab/Research institutions

    Tel:86-15965530500

    Address:Room1701, Tianxing Building,Licheng district, jinan, Shandong, China

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  • Piperazine, 1-(4,5-diphenyl-2-oxazolyl)-4-methyl-

  • Casno:

    20503-88-2

    Piperazine, 1-(4,5-diphenyl-2-oxazolyl)-4-methyl-

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    1.Our services:A.Supply sampleB.The packing also can be according the customers` requirmentC.Any inquiries will be replied within 24 hoursD.we provide Commerical Invoice, Packing List, Bill of loading, COA , Health certificate and Origin certificate.

    Our company engages in Electronic chemicals such as OLED,Photoresist chemical,Electrolyte additive and Intermediate Pharmaceutical production; development of noble metal catalysts,

  •  Henan Tianfu Chemical Co., Ltd.

     China (Mainland)  |  Contact Details

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Specification

The Piperazine, 1-(4,5-diphenyl-2-oxazolyl)-4-methyl-, with the CAS registry number 20503-88-2, is also known as 1-(4,5-Diphenyl-1,3-oxazol-2-yl)-4-methylpiperazine. This chemical's molecular formula is C20H21N3O and molecular weight is 319.4002. What's more, its IUPAC name is called 2-(4-Methylpiperazin-1-yl)-4,5-diphenyl-1,3-oxazole. The classification code is Drug / Therapeutic Agent.

Physical properties about Piperazine, 1-(4,5-diphenyl-2-oxazolyl)-4-methyl- are: (1) ACD/LogP: 2.67; (2) # of Rule of 5 Violations: 0; (3) ACD/LogD (pH 5.5): 1.47; (4) ACD/LogD (pH 7.4): 2.62; (5) ACD/BCF (pH 5.5): 4; (6) ACD/BCF (pH 7.4): 55.99; (7) ACD/KOC (pH 5.5): 42.96; (8) ACD/KOC (pH 7.4): 601.41; (9) #H bond acceptors: 4; (10) #H bond donors: 0; (11) #Freely Rotating Bonds: 3; (12) Polar Surface Area: 32.51 Å2; (13) Index of Refraction: 1.59; (14) Molar Refractivity: 94.3 cm3; (15) Molar Volume: 279.3 cm3; (16) Surface Tension: 44.6 dyne/cm; (17) Density: 1.143 g/cm3; (18)Flash Point: 227 °C; (19) Enthalpy of Vaporization: 71.09 kJ/mol; (20) Boiling Point: 451.8 °C at 760 mmHg; (21) Vapour Pressure: 2.36E-08 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: n1c(c(oc1N2CCN(C)CC2)c3ccccc3)c4ccccc4
(2) InChI: InChI=1/C20H21N3O/c1-22-12-14-23(15-13-22)20-21-18(16-8-4-2-5-9-16)19(24-20)17-10-6-3-7-11-17/h2-11H,12-15H2,1H3
(3) InChIKey: QAYGLHSZAFDOJZ-UHFFFAOYAI

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo oral 850mg/kg (850mg/kg)   Journal of Medicinal Chemistry. Vol. 11, Pg. 1092, 1968