Home Other Building Blocks 1-(4,5,6,7-tetrahydro-1-benzothiophen-2-ylmethyl)piperazine

1-(4,5,6,7-tetrahydro-1-benzothiophen-2-ylmethyl)piperazine

CAS No.:
1250557-86-8
Catalog Number:
AG01AAYI
Molecular Formula:
C13H20N2S
Molecular Weight:
236.3763
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Product Description
Catalog Number:
AG01AAYI
Chemical Name:
1-(4,5,6,7-tetrahydro-1-benzothiophen-2-ylmethyl)piperazine
CAS Number:
1250557-86-8
Molecular Formula:
C13H20N2S
Molecular Weight:
236.3763
MDL Number:
MFCD16778377
IUPAC Name:
1-(4,5,6,7-tetrahydro-1-benzothiophen-2-ylmethyl)piperazine
InChI:
InChI=1S/C13H20N2S/c1-2-4-13-11(3-1)9-12(16-13)10-15-7-5-14-6-8-15/h9,14H,1-8,10H2
InChI Key:
QPLYIIXLSILJDD-UHFFFAOYSA-N
SMILES:
N1CCN(CC1)Cc1cc2c(s1)CCCC2
Properties
Complexity:
228  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.135g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
236.377g/mol
Monoisotopic Mass:
236.135g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties