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2-[(4-bromobenzoyl)carbamothioylamino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide

2-[(4-bromobenzoyl)carbamothioylamino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide structure

CAS No:
370576-99-1
Formula:
C19H20BrN3O2S2
Chemical Name:
2-[(4-bromobenzoyl)carbamothioylamino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
Synonyms:
ZINC2316703;STK840599;AKOS001616180;MCULE-7656465434;SR-01000448072;SR-01000448072-1;2-({[(4-bromobenzoyl)amino]carbonothioyl}amino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide;2-({[(4-bromophenyl)carbonyl]carbamothioyl}amino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide;370576-99-1

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2-[(4-bromobenzoyl)carbamothioylamino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide Basic Attributes

Molecular Weight：

466.4 g/mol

Exact Mass：

465.01803 g/mol

Characteristics

PSA：

145 Å²

Computed Properties

Molecular Weight:466.4
XLogP3:5.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:465.01803
Monoisotopic Mass:465.01803
Topological Polar Surface Area:145
Heavy Atom Count:27
Complexity:569
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[(4-bromobenzoyl)carbamothioylamino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide

Basic Attributes
Characteristics
Computed Properties

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