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

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

CAS No.:
1803597-91-2
Catalog Number:
AG019M4I
Molecular Formula:
C11H15ClN4OS
Molecular Weight:
286.7810
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Product Description
Catalog Number:
AG019M4I
Chemical Name:
1-{[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]methyl}piperazine hydrochloride
CAS Number:
1803597-91-2
Molecular Formula:
C11H15ClN4OS
Molecular Weight:
286.7810
MDL Number:
MFCD28145655
IUPAC Name:
5-(piperazin-1-ylmethyl)-3-thiophen-2-yl-1,2,4-oxadiazole;hydrochloride
InChI:
InChI=1S/C11H14N4OS.ClH/c1-2-9(17-7-1)11-13-10(16-14-11)8-15-5-3-12-4-6-15;/h1-2,7,12H,3-6,8H2;1H
InChI Key:
BKIQJDQDJXTJSZ-UHFFFAOYSA-N
SMILES:
N1CCN(CC1)Cc1onc(n1)c1cccs1.Cl
Properties
Complexity:
250  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.066g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
286.778g/mol
Monoisotopic Mass:
286.066g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
82.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties