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Dexecadotril

Dexecadotril structure

CAS No:
112573-72-5
Formula:
C21H23NO4S
Chemical Name:
Dexecadotril
Synonyms:
Dexecadotril;N-[(R)-2-[(Acetylthio)methyl]-1-oxo-3-phenylpropyl]glycine benzyl ester;N-[(R)-2-Benzyl-3-(acetylthio)propionyl]glycine benzyl ester;R-Acetorphan;Retorphan;Surotomycin

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Dexecadotril Basic Attributes

Molecular Weight：

385.482

Exact Mass：

385.13500

UNII：

5OFI9D9892

DSSTox ID：

DTXSID90150104

Characteristics

PSA：

97.8

XLogP3：

3.82490

Density：

1.206g/cm3

Boiling Point：

574.5ºC at 760 mmHg

Flash Point：

301.2ºC

Refractive Index：

1.578

Drug Information

MeSH Entry Terms：

dexecadotril

Computed Properties

Molecular Weight:385.5
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:11
Exact Mass:385.13477939
Monoisotopic Mass:385.13477939
Topological Polar Surface Area:97.8
Heavy Atom Count:27
Complexity:485
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Dexecadotril

Basic Attributes
Characteristics
Drug Information
Computed Properties

Dexecadotril

SDS

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