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23409-32-7

23409-32-7 | 2,5-Piperazinedione, 3,6-bis(4-aminobutyl)-, (3S,6S)-

CAS No: 23409-32-7 Catalog No: AG002N4J MDL No:

Product Description

Catalog Number:
AG002N4J
Chemical Name:
2,5-Piperazinedione, 3,6-bis(4-aminobutyl)-, (3S,6S)-
CAS Number:
23409-32-7
Molecular Formula:
C12H24N4O2
Molecular Weight:
256.3446
IUPAC Name:
(3S,6S)-3,6-bis(4-aminobutyl)piperazine-2,5-dione
InChI:
InChI=1S/C12H24N4O2/c13-7-3-1-5-9-11(17)16-10(12(18)15-9)6-2-4-8-14/h9-10H,1-8,13-14H2,(H,15,18)(H,16,17)/t9-,10-/m0/s1
InChI Key:
NUYHTXOPSQBZKC-UWVGGRQHSA-N
SMILES:
NCCCC[C@@H]1NC(=O)[C@@H](NC1=O)CCCCN

Properties

Complexity:
255  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
256.19g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
256.35g/mol
Monoisotopic Mass:
256.19g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1  

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