Home Other Building Blocks 1-{3-[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]propyl}piperazine dihydrochloride

1-{3-[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]propyl}piperazine dihydrochloride

CAS No.:
1170455-92-1
Catalog Number:
AG019NGM
Molecular Formula:
C13H20Cl2N4OS
Molecular Weight:
351.2951
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Product Description
Catalog Number:
AG019NGM
Chemical Name:
1-{3-[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]propyl}piperazine dihydrochloride
CAS Number:
1170455-92-1
Molecular Formula:
C13H20Cl2N4OS
Molecular Weight:
351.2951
MDL Number:
MFCD11505589
IUPAC Name:
5-(3-piperazin-1-ylpropyl)-3-thiophen-2-yl-1,2,4-oxadiazole;dihydrochloride
InChI:
InChI=1S/C13H18N4OS.2ClH/c1(7-17-8-5-14-6-9-17)4-12-15-13(16-18-12)11-3-2-10-19-11;;/h2-3,10,14H,1,4-9H2;2*1H
InChI Key:
BQBBDYVPHSOMQZ-UHFFFAOYSA-N
SMILES:
N1CCN(CC1)CCCc1onc(n1)c1cccs1.Cl.Cl
Properties
Complexity:
275  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
350.073g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
351.29g/mol
Monoisotopic Mass:
350.073g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
82.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties