5-(2,6-Dichlorophenyl)-2-[(2,4-difluorophenyl)thio]-6H-pyrimido[1,6-b]pyridazin-6-one
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![5-(2,6-Dichlorophenyl)-2-[(2,4-difluorophenyl)thio]-6H-pyrimido[1,6-b]pyridazin-6-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/a432eecd2dec4f88a3c0475ea000f0c1.png "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)thio]-6H-pyrimido[1,6-b]pyridazin-6-one
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CAS No:
209410-46-8
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Formula:
C19H9Cl2F2N3OS
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Chemical Name:
5-(2,6-Dichlorophenyl)-2-[(2,4-difluorophenyl)thio]-6H-pyrimido[1,6-b]pyridazin-6-one
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Synonyms:
6H-Pyrimido[1,6-b]pyridazin-6-one,5-(2,6-dichlorophenyl)-2-[(2,4-difluorophenyl)thio]-;5-(2,6-Dichlorophenyl)-2-[(2,4-difluorophenyl)thio]-6H-pyrimido[1,6-b]pyridazin-6-one;VX 745;Neflamapimod;VRT 031745;VD 31745
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CAS No:
Description
Neflamapimod (VX-745) is a potent and selective inhibitor of p38α, and possesses anti-inflammatory activity.
VX-745 is a member of the class of pyrimidopyridazines that is 6H-pyrimido[1,6-b]pyridazin-6-one substituted at positions 2 and 5 by (2,4-difluorophenyl)sulfanyl and 2,6-dichlorophenyl groups respectively It has a role as an EC 2.7.11.24 (mitogen-activated protein kinase) inhibitor, an anti-inflammatory drug and an apoptosis inducer. It is a pyrimidopyridazine, a difluorobenzene, a dichlorobenzene and an aryl sulfide.|Neflamapimod has been used in trials studying the treatment of Alzheimer's Disease and Mild Cognitive Impairment.
5-(2,6-Dichlorophenyl)-2-[(2,4-difluorophenyl)thio]-6H-pyrimido[1,6-b]pyridazin-6-one Basic Attributes
436.26
436.26
TYL52QM320
DTXSID90175115
2933990090
Characteristics
70.3
5.1
1.6±0.1 g/cm3
261-264 °C
578.9ºC at 760mmHg
303.9±32.9 °C
1.692
Store at -20°C
2.13E-13mmHg at 25°C
5-(2,6-Dichlorophenyl)-2-[(2,4-difluorophenyl)thio]-6H-pyrimido[1,6-b]pyridazin-6-one Use and Manufacturing
VX 745 is a potent and selective inhibitor of p38α mitogen-activated protein (MAP) kinase. VX 745 is a potential anti-inflammatory agents. Studies suggest that VX 745 may be useful in the treatment of Werner syndrome.
Computed Properties
Molecular Weight:436.3
XLogP3:5.1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:434.9811448
Monoisotopic Mass:434.9811448
Topological Polar Surface Area:70.3
Heavy Atom Count:28
Complexity:762
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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5-(2,6-Dichlorophenyl)-2-[(2,4-difluorophenyl)thio]-6H-pyrimido[1,6-b]pyridazin-6-one
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