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ethyl 2-[(2-bromobenzoyl)amino]-4,5-dihydrobenzo[g][1]benzothiole-3-carboxylate

ethyl 2-[(2-bromobenzoyl)amino]-4,5-dihydrobenzo[g][1]benzothiole-3-carboxylate structure

CAS No:
500197-00-2
Formula:
C22H18BrNO3S
Chemical Name:
ethyl 2-[(2-bromobenzoyl)amino]-4,5-dihydrobenzo[g][1]benzothiole-3-carboxylate
Synonyms:
SMR000143812;ethyl 2-[(2-bromobenzoyl)amino]-4,5-dihydronaphtho[1,2-b]thiophene-3-carboxylate;MLS000537374;MLS002547581;CHEMBL1539920;HMS2395F07;ZINC1744612;STK841196;AKOS005625179;MCULE-1061932638;ethyl 2-{[(2-bromophenyl)carbonyl]amino}-4,5-dihydronaphtho[1,2-b]thiophene-3-carboxylate;500197-00-2

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ethyl 2-[(2-bromobenzoyl)amino]-4,5-dihydrobenzo[g][1]benzothiole-3-carboxylate Basic Attributes

Molecular Weight：

456.4 g/mol

Exact Mass：

455.01908 g/mol

Characteristics

PSA：

83.6 Å²

Computed Properties

Molecular Weight:456.4
XLogP3:6.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:455.01908
Monoisotopic Mass:455.01908
Topological Polar Surface Area:83.6
Heavy Atom Count:28
Complexity:588
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 2-[(2-bromobenzoyl)amino]-4,5-dihydrobenzo[g][1]benzothiole-3-carboxylate

Basic Attributes
Characteristics
Computed Properties
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