2-[(3,4-dimethoxybenzoyl)carbamothioylamino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
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2-[(3,4-dimethoxybenzoyl)carbamothioylamino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
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CAS No:
369403-76-9
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Formula:
C21H25N3O4S2
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Chemical Name:
2-[(3,4-dimethoxybenzoyl)carbamothioylamino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
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Synonyms:
ZINC2316294;STK840374;AKOS001616226;MCULE-5789655200;SR-01000448075;SR-01000448075-1;2-({[(3,4-dimethoxybenzoyl)amino]carbonothioyl}amino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide;2-({[(3,4-dimethoxyphenyl)carbonyl]carbamothioyl}amino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide;369403-76-9
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CAS No:
2-[(3,4-dimethoxybenzoyl)carbamothioylamino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide Basic Attributes
447.6 g/mol
447.12864863 g/mol
Computed Properties
Molecular Weight:447.6
XLogP3:4.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:447.12864863
Monoisotopic Mass:447.12864863
Topological Polar Surface Area:163
Heavy Atom Count:30
Complexity:635
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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