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Home Other Building Blocks 1246819-01-1
1246819-01-1,MFCD31562595
Catalog No.:AA009EVX

1246819-01-1 | N-Isopropyl Carvedilol

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Technical Information
Catalog Number:
AA009EVX
Chemical Name:
N-Isopropyl Carvedilol
CAS Number:
1246819-01-1
Molecular Formula:
C27H32N2O4
Molecular Weight:
448.5540
MDL Number:
MFCD31562595
SMILES:
COc1ccccc1OCCN(C(C)C)CC(COc1cccc2c1c1ccccc1[nH]2)O
Properties
Computed Properties
 
Complexity:
576  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
33  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
11  
Undefined Atom Stereocenter Count:
1  
XLogP3:
5.5  

Literature
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Additional Info:
SDS
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Tags:1246819-01-1 Molecular Formula|1246819-01-1 MDL|1246819-01-1 SMILES|1246819-01-1 N-Isopropyl Carvedilol