1-phenyl-4-thiophen-2-ylsulfonylpiperazine

C14H16N2O2S2 — CID 738300

IUPAC1-phenyl-4-thiophen-2-ylsulfonylpiperazine
SMILESO=S(=O)(c1cccs1)N1CCN(c2ccccc2)CC1
InChIInChI=1S/C14H16N2O2S2/c17-20(18,14-7-4-12-19-14)16-10-8-15(9-11-16)13-5-2-1-3-6-13/h1-7,12H,8-11H2
InChIKeyWSNQSFFPDHHTCT-UHFFFAOYSA-N
MW308.43 g/mol
LogP2.26
Rot. Bonds3

About 1-phenyl-4-thiophen-2-ylsulfonylpiperazine

1-phenyl-4-thiophen-2-ylsulfonylpiperazine (PubChem CID 738300) has the molecular formula C14H16N2O2S2 and a molecular weight of 308.43 g/mol. Its IUPAC name is 1-phenyl-4-thiophen-2-ylsulfonylpiperazine.

Molecular Properties

Compound Name1-phenyl-4-thiophen-2-ylsulfonylpiperazine
PubChem CID738300
Molecular FormulaC14H16N2O2S2
Molecular Weight308.43 g/mol
Exact Mass308.07
IUPAC Name1-phenyl-4-thiophen-2-ylsulfonylpiperazine
SMILESO=S(=O)(c1cccs1)N1CCN(c2ccccc2)CC1
InChIInChI=1S/C14H16N2O2S2/c17-20(18,14-7-4-12-19-14)16-10-8-15(9-11-16)13-5-2-1-3-6-13/h1-7,12H,8-11H2
InChIKeyWSNQSFFPDHHTCT-UHFFFAOYSA-N
XLogP2.26
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.43
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-4-thiophen-2-ylsulfonylpiperazine?
The IUPAC name of 1-phenyl-4-thiophen-2-ylsulfonylpiperazine (CID 738300) is 1-phenyl-4-thiophen-2-ylsulfonylpiperazine.
What is the SMILES notation for 1-phenyl-4-thiophen-2-ylsulfonylpiperazine?
The canonical SMILES for 1-phenyl-4-thiophen-2-ylsulfonylpiperazine is O=S(=O)(c1cccs1)N1CCN(c2ccccc2)CC1.
What is the InChIKey of 1-phenyl-4-thiophen-2-ylsulfonylpiperazine?
The InChIKey is WSNQSFFPDHHTCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2S2/c17-20(18,14-7-4-12-19-14)16-10-8-15(9-11-16)13-5-2-1-3-6-13/h1-7,12H,8-11H2.
What are the key properties of 1-phenyl-4-thiophen-2-ylsulfonylpiperazine?
1-phenyl-4-thiophen-2-ylsulfonylpiperazine has a molecular weight of 308.43 g/mol, XLogP of 2.26, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-4-thiophen-2-ylsulfonylpiperazine is sourced from PubChem (CID 738300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).