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1-(1-Benzothiophen-4-Yl)Piperazine;Hydrochloride
PharmaCompass
1-(1-Benzothiophen-4-Yl)Piperazine;Hydrochloride
Also known as: 913614-18-3, 1-(benzo[b]thiophen-4-yl)piperazine hydrochloride, 1-(1-benzothiophen-4-yl)piperazine hydrochloride, Piperazine, 1-benzo[b]thien-4-yl-, hydrochloride, Ak171379, 1-benzo[b]thien-4-yl-piperazine hydrochloride
Molecular Formula
C12H15ClN2S
Molecular Weight
254.776  g/mol
InChI Key
XDUUWPNOUUQXBX-UHFFFAOYSA-N

1 2D Structure

1-(1-Benzothiophen-4-Yl)Piperazine;Hydrochloride

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1-(1-benzothiophen-4-yl)piperazine;hydrochloride
2.1.2 InChI
InChI=1S/C12H14N2S.ClH/c1-2-11(14-7-5-13-6-8-14)10-4-9-15-12(10)3-1;/h1-4,9,13H,5-8H2;1H
2.1.3 InChI Key
XDUUWPNOUUQXBX-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CN(CCN1)C2=C3C=CSC3=CC=C2.Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 913614-18-3

2. 1-(benzo[b]thiophen-4-yl)piperazine Hydrochloride

3. 1-(1-benzothiophen-4-yl)piperazine Hydrochloride

4. Piperazine, 1-benzo[b]thien-4-yl-, Hydrochloride

5. Ak171379

6. 1-benzo[b]thien-4-yl-piperazine Hydrochloride

7. Piperazine,1-benzo[b]thien-4-yl-,hydrochloride

8. Schembl294116

9. Molport-039-016-770

10. Xduuwpnouuqxbx-uhfffaoysa-n

11. Mfcd26743820

12. 1-benzo[b]thien-4-yl-piperazine Hcl

13. Akos025291106

14. Ds-7609

15. Ks-0000065o

16. Bc600278

17. Or305616

18. Sc-97513

19. Kb-275081

20. Ft-0718164

21. 1-benzo[b]thiophen-4-ylpiperazine Hydrochloride

22. Z-3055

23. 1-(1-benzothiophen-4-yl)piperazine Hcl

24. 1-benzo[b]thiophen-4-yl Piperazine Hydrochloride

25. 1-benzo[b]thiophen-4-yl-piperazine Hydrochloride

26. 4-(1-piperazinyl)benzo[b]thiophene Hydrochloride

27. L-benzo[b]thiophen-4-yl-piperazine Hydrochloride

28. 1-benzo[b]thiophene-4-yl-piperazine Hydrochloride

29. L-benzo[b]thiophene-4-yl-piperazine Hydrochloride

30. Piperazine, 1-benzo[b]thien-4-yl-, Hydrochloride (

31. 1-benzo[b]thien-4-yl-piperazine Hydrochloride, Aldrichcpr

2.3 Create Date
2012-08-08
3 Chemical and Physical Properties
Molecular Weight 254.776 g/mol
Molecular Formula C12H15ClN2S
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass254.064 g/mol
Monoisotopic Mass254.064 g/mol
Topological Polar Surface Area43.5 A^2
Heavy Atom Count16
Formal Charge0
Complexity216
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2
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