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4-bromo-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide

4-bromo-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide structure

CAS No:
956611-38-4
Formula:
C13H17BrN2O2
Chemical Name:
4-bromo-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide
Synonyms:
MLS000516935;HMS2691F19;ZINC2626505;AKOS034827320;MCULE-9037917740;SMR000343050;Z57009632;(2S)-2-[(4-bromophenyl)formamido]-N-propylpropanamide;956611-38-4

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4-bromo-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide Basic Attributes

Molecular Weight：

313.19 g/mol

Exact Mass：

312.04734 g/mol

Characteristics

PSA：

58.2 Å²

Water Solubility：

>47 [ug/mL]

Computed Properties

Molecular Weight:313.19
XLogP3:2.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:312.04734
Monoisotopic Mass:312.04734
Topological Polar Surface Area:58.2
Heavy Atom Count:18
Complexity:289
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-bromo-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide

Basic Attributes
Characteristics
Computed Properties

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