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1955561-88-2

1955561-88-2 | 1-{thieno[3,2-c]pyridin-4-yl}piperazine trihydrochloride

CAS No: 1955561-88-2 Catalog No: AG01BBVK MDL No:MFCD17079026

Product Description

Catalog Number:
AG01BBVK
Chemical Name:
1-{thieno[3,2-c]pyridin-4-yl}piperazine trihydrochloride
CAS Number:
1955561-88-2
Molecular Formula:
C11H16Cl3N3S
Molecular Weight:
328.6888
MDL Number:
MFCD17079026
IUPAC Name:
4-piperazin-1-ylthieno[3,2-c]pyridine;trihydrochloride
InChI:
InChI=1S/C11H13N3S.3ClH/c1-3-13-11(9-2-8-15-10(1)9)14-6-4-12-5-7-14;;;/h1-3,8,12H,4-7H2;3*1H
InChI Key:
SDIORWUUIMGTCR-UHFFFAOYSA-N
SMILES:
N1CCN(CC1)c1nccc2c1ccs2.Cl.Cl.Cl

Properties

Complexity:
218  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
4  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.013g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
328.68g/mol
Monoisotopic Mass:
327.013g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
56.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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