Home Amines 1031281-07-8
1031281-07-8,MFCD00169322
Catalog No.:AA00IUMJ

1031281-07-8 | 4-(4-bromophenyl)-4-oxo-2-{[(thiophen-2-yl)methyl]amino}butanoic acid

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Technical Information
Catalog Number:
AA00IUMJ
Chemical Name:
4-(4-bromophenyl)-4-oxo-2-{[(thiophen-2-yl)methyl]amino}butanoic acid
CAS Number:
1031281-07-8
Molecular Formula:
C15H14BrNO3S
Molecular Weight:
368.2456
MDL Number:
MFCD00169322
SMILES:
OC(=O)C(CC(=O)c1ccc(cc1)Br)NCc1cccs1
Properties
Computed Properties
 
Complexity:
372  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
7  
Undefined Atom Stereocenter Count:
1  
XLogP3:
0.4  

Literature
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SDS
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Tags:1031281-07-8 Molecular Formula|1031281-07-8 MDL|1031281-07-8 SMILES|1031281-07-8 4-(4-bromophenyl)-4-oxo-2-{[(thiophen-2-yl)methyl]amino}butanoic acid