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1H-Pyrrole-3-carboxylicacid, 2-(1-isoquinolinyl)-5-phenyl-4-sulfo-

1H-Pyrrole-3-carboxylicacid, 2-(1-isoquinolinyl)-5-phenyl-4-sulfo- structure

CAS No:
13226-11-4
Formula:
C20H14N2O5S
Chemical Name:
1H-Pyrrole-3-carboxylicacid, 2-(1-isoquinolinyl)-5-phenyl-4-sulfo-
Synonyms:
1H-Pyrrole-3-carboxylicacid, 2-(1-isoquinolinyl)-5-phenyl-4-sulfo-

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1H-Pyrrole-3-carboxylicacid, 2-(1-isoquinolinyl)-5-phenyl-4-sulfo- Basic Attributes

Molecular Weight：

394.40056

Exact Mass：

394.06234272 g/mol

NSC Number：

116654

DSSTox ID：

DTXSID10297580

Characteristics

PSA：

129 Å²

Computed Properties

Molecular Weight:394.4
XLogP3:2.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:394.06234272
Monoisotopic Mass:394.06234272
Topological Polar Surface Area:129
Heavy Atom Count:28
Complexity:673
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1H-Pyrrole-3-carboxylicacid, 2-(1-isoquinolinyl)-5-phenyl-4-sulfo-

Basic Attributes
Characteristics
Computed Properties

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