 Home > Encyclopedia > 2-[[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

2-[[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

2-[[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide structure

CAS No:
556006-14-5
Formula:
C16H17N3O3S2
Chemical Name:
2-[[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Synonyms:
ZINC3323177;AKOS017003753;SR-01000044300;SR-01000044300-1;Z18545718;2-({[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]methyl}sulfanyl)pyridin-1-ium-1-olate;556006-14-5

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2-[[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Basic Attributes

Molecular Weight：

363.5 g/mol

Exact Mass：

363.07113376 g/mol

Characteristics

PSA：

151 Å²

Computed Properties

Molecular Weight:363.5
XLogP3:2.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:363.07113376
Monoisotopic Mass:363.07113376
Topological Polar Surface Area:151
Heavy Atom Count:24
Complexity:480
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Basic Attributes
Characteristics
Computed Properties

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