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

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

CAS No:
63183-27-7
Formula:
C17H18N2O6S2
Chemical Name:
ethyl 2-[(4-nitrophenyl)sulfonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Synonyms:
ethyl 2-{[(4-nitrophenyl)sulfonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate;63183-27-7;Oprea1_170115;Oprea1_483737;CBDivE_003892;ZINC5967287;BBL003918;MFCD00294955;STK282385;AKOS001782196;MCULE-2343618449;VS-01452;T8466;SR-01000196399;SR-01000196399-1;ETHYL 2-(4-NITROBENZENESULFONAMIDO)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE

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

Molecular Weight：

410.5 g/mol

Exact Mass：

410.06062865 g/mol

Characteristics

PSA：

155 Å²

XLogP3：

5.1896

Melting Point：

133 - 135 °C (isopropyl alcohol)

Computed Properties

Molecular Weight:410.5
XLogP3:4.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:410.06062865
Monoisotopic Mass:410.06062865
Topological Polar Surface Area:155
Heavy Atom Count:27
Complexity:651
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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

Basic Attributes
Characteristics
Computed Properties
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