1-phenyl-3-[2-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylsulfanyl)phenyl]urea
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1-phenyl-3-[2-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylsulfanyl)phenyl]urea
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CAS No:
716364-27-1
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Formula:
C23H20N4OS2
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Chemical Name:
1-phenyl-3-[2-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylsulfanyl)phenyl]urea
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Synonyms:
ZINC3192712;AKOS034455106;MCULE-8028545761;Z56790004;3-phenyl-1-(2-{8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2,4,6-tetraen-3-ylsulfanyl}phenyl)urea;716364-27-1
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CAS No:
1-phenyl-3-[2-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylsulfanyl)phenyl]urea Basic Attributes
432.6 g/mol
432.10785362 g/mol
Computed Properties
Molecular Weight:432.6
XLogP3:5.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:432.10785362
Monoisotopic Mass:432.10785362
Topological Polar Surface Area:120
Heavy Atom Count:30
Complexity:588
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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