(1R,9R)-N-(3-chloro-4-fluorophenyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carbothioamide
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(1R,9R)-N-(3-chloro-4-fluorophenyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carbothioamide
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CAS No:
1082668-56-1
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Formula:
C18H17ClFN3OS
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Chemical Name:
(1R,9R)-N-(3-chloro-4-fluorophenyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carbothioamide
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Synonyms:
ZINC2157156;AKOS030499361;1082668-56-1
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CAS No:
(1R,9R)-N-(3-chloro-4-fluorophenyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carbothioamide Basic Attributes
377.9 g/mol
377.0764892 g/mol
Computed Properties
Molecular Weight:377.9
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:377.0764892
Monoisotopic Mass:377.0764892
Topological Polar Surface Area:67.7
Heavy Atom Count:25
Complexity:640
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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