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209410-46-8

Basic Information
CAS No.: 209410-46-8
Name: VX-745
Molecular Structure:
Molecular Structure of 209410-46-8 (VX-745)
Formula: C19H9Cl2F2N3OS
Molecular Weight: 436.26
Synonyms: VX 745;5-(2,6-Dichlorophenyl)-2-((2,4-difluorophenyl)thio)-6H-pyrimido[1,6-b]pyridazin-6-one;5-(2,6-Dichlorophenyl)-2-(2,4-difluorophenyl)sulfanylpyridazino[6,1-f]pyrimidin-6-one;
Density: 1.55g/cm3
Melting Point: 261-264 °C
Boiling Point: 578.9 °C at 760 mmHg
Flash Point: 303.9 °C
PSA: 72.56000
LogP: 5.49270
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  • VX745 with factory price

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    209410-46-8

    VX745 with factory price

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    Wuhan Prominence Bio-technology Co., Ltd is a leading provider and manufacturer of pharmaceutical and chemical products. Mainly involves API, pharmaceutical intermediates peditides and natural extract etc. We are capable to supply you with any quanti

    Wuhan Prominence Bio-technology Co., Ltd is a leading provider and manufacturer of pharmaceutical and chemical products. Mainly involves API, pharmaceutical intermediates peptides

  • Wuhan Prominence Bio-technology Co., Ltd

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Specification

The 5-(2,6-Dichlorophenyl)-2-((2,4-difluorophenyl)thio)-6H-pyrimido[1,6-b]pyridazin-6-one with the CAS number 209410-46-8 is also called 6H-Pyrimido[1,6-b]pyridazin-6-one,5-(2,6-dichlorophenyl)-2-[(2,4-difluorophenyl)thio]-. Its molecular formula is C19H9Cl2F2N3OS. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the 5-(2,6-Dichlorophenyl)-2-((2,4-difluorophenyl)thio)-6H-pyrimido[1,6-b]pyridazin-6-one are: (1)ACD/LogP: 4.79; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.79; (4)ACD/LogD (pH 7.4): 4.79; (5)ACD/BCF (pH 5.5): 2585.33; (6)ACD/BCF (pH 7.4): 2585.33; (7)ACD/KOC (pH 5.5): 9644.4; (8)ACD/KOC (pH 7.4): 9644.4; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 70.33 Å2; (13)Index of Refraction: 1.692; (14)Molar Refractivity: 107.58 cm3; (15)Molar Volume: 280.6 cm3; (16)Polarizability: 42.64×10-24cm3; (17)Surface Tension: 52.5 dyne/cm; (18)Enthalpy of Vaporization: 86.63 kJ/mol; (19)Vapour Pressure: 2.13×10-13 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc4ccc(S\C1=N\N/2C(\C=C1)=C(/C(=O)\N=C\2)c3c(Cl)cccc3Cl)c(F)c4
(2)InChI: InChI=1/C19H9Cl2F2N3OS/c20-11-2-1-3-12(21)17(11)18-14-5-7-16(25-26(14)9-24-19(18)27)28-15-6-4-10(22)8-13(15)23/h1-9H
(3)InChIKey: VEPKQEUBKLEPRA-UHFFFAOYAR