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ethyl 2-[(3,4,5-trimethoxybenzoyl)carbamothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

ethyl 2-[(3,4,5-trimethoxybenzoyl)carbamothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate structure

CAS No:
364616-76-2
Formula:
C22H26N2O6S2
Chemical Name:
ethyl 2-[(3,4,5-trimethoxybenzoyl)carbamothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Synonyms:
ZINC2237060;STK173164;AKOS000619311;MCULE-2301957936;364616-76-2;ethyl 2-({[(3,4,5-trimethoxyphenyl)carbonyl]carbamothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate;ethyl 2-(3-(3,4,5-trimethoxybenzoyl)thioureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate

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ethyl 2-[(3,4,5-trimethoxybenzoyl)carbamothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Basic Attributes

Molecular Weight：

478.6 g/mol

Exact Mass：

478.12322890 g/mol

Characteristics

PSA：

155 Å²

Computed Properties

Molecular Weight:478.6
XLogP3:4.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:8
Exact Mass:478.12322890
Monoisotopic Mass:478.12322890
Topological Polar Surface Area:155
Heavy Atom Count:32
Complexity:667
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 2-[(3,4,5-trimethoxybenzoyl)carbamothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Basic Attributes
Characteristics
Computed Properties
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