N-phenyl-7-piperazin-1-ylthieno[2,3-c]pyridine-2-sulfonamide

C17H18N4O2S2 — CID 67157197

IUPACN-phenyl-7-piperazin-1-ylthieno[2,3-c]pyridine-2-sulfonamide
SMILESO=S(=O)(Nc1ccccc1)c1cc2ccnc(N3CCNCC3)c2s1
InChIInChI=1S/C17H18N4O2S2/c22-25(23,20-14-4-2-1-3-5-14)15-12-13-6-7-19-17(16(13)24-15)21-10-8-18-9-11-21/h1-7,12,18,20H,8-11H2
InChIKeyJDTGGUYMYBZFAY-UHFFFAOYSA-N
MW374.49 g/mol
LogP2.51
Rot. Bonds4

About N-phenyl-7-piperazin-1-ylthieno[2,3-c]pyridine-2-sulfonamide

N-phenyl-7-piperazin-1-ylthieno[2,3-c]pyridine-2-sulfonamide (PubChem CID 67157197) has the molecular formula C17H18N4O2S2 and a molecular weight of 374.49 g/mol. Its IUPAC name is N-phenyl-7-piperazin-1-ylthieno[2,3-c]pyridine-2-sulfonamide.

Molecular Properties

Compound NameN-phenyl-7-piperazin-1-ylthieno[2,3-c]pyridine-2-sulfonamide
PubChem CID67157197
Molecular FormulaC17H18N4O2S2
Molecular Weight374.49 g/mol
Exact Mass374.09
IUPAC NameN-phenyl-7-piperazin-1-ylthieno[2,3-c]pyridine-2-sulfonamide
SMILESO=S(=O)(Nc1ccccc1)c1cc2ccnc(N3CCNCC3)c2s1
InChIInChI=1S/C17H18N4O2S2/c22-25(23,20-14-4-2-1-3-5-14)15-12-13-6-7-19-17(16(13)24-15)21-10-8-18-9-11-21/h1-7,12,18,20H,8-11H2
InChIKeyJDTGGUYMYBZFAY-UHFFFAOYSA-N
XLogP2.51
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.49
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-phenyl-7-piperazin-1-ylthieno[2,3-c]pyridine-2-sulfonamide?
The IUPAC name of N-phenyl-7-piperazin-1-ylthieno[2,3-c]pyridine-2-sulfonamide (CID 67157197) is N-phenyl-7-piperazin-1-ylthieno[2,3-c]pyridine-2-sulfonamide.
What is the SMILES notation for N-phenyl-7-piperazin-1-ylthieno[2,3-c]pyridine-2-sulfonamide?
The canonical SMILES for N-phenyl-7-piperazin-1-ylthieno[2,3-c]pyridine-2-sulfonamide is O=S(=O)(Nc1ccccc1)c1cc2ccnc(N3CCNCC3)c2s1.
What is the InChIKey of N-phenyl-7-piperazin-1-ylthieno[2,3-c]pyridine-2-sulfonamide?
The InChIKey is JDTGGUYMYBZFAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O2S2/c22-25(23,20-14-4-2-1-3-5-14)15-12-13-6-7-19-17(16(13)24-15)21-10-8-18-9-11-21/h1-7,12,18,20H,8-11H2.
What are the key properties of N-phenyl-7-piperazin-1-ylthieno[2,3-c]pyridine-2-sulfonamide?
N-phenyl-7-piperazin-1-ylthieno[2,3-c]pyridine-2-sulfonamide has a molecular weight of 374.49 g/mol, XLogP of 2.51, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-7-piperazin-1-ylthieno[2,3-c]pyridine-2-sulfonamide is sourced from PubChem (CID 67157197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).