N-[4-[(6,7-Dimethoxy-4-quinolinyl)oxy]-2-methoxyphenyl]-N'-[1-(2-thiazolyl)ethyl]urea supplier

Name
N-[4-[(6,7-Dimethoxy-4-quinolinyl)oxy]-2-methoxyphenyl]-N'-[1-(2-thiazolyl)ethyl]urea
EINECS 200-258-5
CAS No. 623142-96-1
Density 1.328
Solubility
Melting Point
Formula C₂₄H₂₄N₄O₅S
Boiling Point 621.788 °C at 760 mmHg
Molecular Weight 480.54
Flash Point 329.846 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1-{4-[(6,7-dimethoxyquinolin-4-yl)oxy]-2-methoxyphenyl}-3-[1-(1,3-thiazol-2-yl)ethyl]urea;
PSA 132.07000
LogP 5.85600

N-[4-[(6,7-Dimethoxy-4-quinolinyl)oxy]-2-methoxyphenyl]-N'-[1-(2-thiazolyl)ethyl]urea Specification

The N-[4-[(6,7-Dimethoxy-4-quinolinyl)oxy]-2-methoxyphenyl]-N'-[1-(2-thiazolyl)ethyl]urea, with the cas registry number 623142-96-1, has the systematic name of 1-{4-[(6,7-dimethoxyquinolin-4-yl)oxy]-2-methoxyphenyl}-3-[1-(1,3-thiazol-2-yl)ethyl]urea. And the molecular fomula of the chemical is C₂₄H₂₄N₄O₅S.

The characteristics of this chemical are as followings: (1)ACD/LogP: 2.41; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 4; (5)ACD/BCF (pH 5.5): 175; (6)ACD/BCF (pH 7.4): 459; (7)ACD/KOC (pH 5.5): 1059; (8)ACD/KOC (pH 7.4): 2781; (9)#H bond acceptors: 9; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 132.07 Å²; (13)Index of Refraction: 1.651; (14)Molar Refractivity: 132.131 cm³; (15)Molar Volume: 361.925 cm³; (16)Polarizability: 52.381×10^-24cm³; (17)Surface Tension: 55.081 dyne/cm; (18)Density: 1.328 g/cm³; (19)Flash Point: 329.846 °C; (20)Enthalpy of Vaporization: 92.124 kJ/mol; (21)Boiling Point: 621.788 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C(NC(c1nccs1)C)Nc4ccc(Oc2c3cc(OC)c(OC)cc3ncc2)cc4OC
(2)InChI: InChI=1/C24H24N4O5S/c1-14(23-26-9-10-34-23)27-24(29)28-17-6-5-15(11-20(17)30-2)33-19-7-8-25-18-13-22(32-4)21(31-3)12-16(18)19/h5-14H,1-4H3,(H2,27,28,29)
(3)InChIKey: SHPFDGWALWEPGS-UHFFFAOYAR

Product Name

N-[4-[(6,7-Dimethoxy-4-quinolinyl)oxy]-2-methoxyphenyl]-N'-[1-(2-thiazolyl)ethyl]urea

N-[4-[(6,7-Dimethoxy-4-quinolinyl)oxy]-2-methoxyphenyl]-N'-[1-(2-thiazolyl)ethyl]urea Specification

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