2-chloro-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide

C12H10ClN3O2S2 — CID 47254419

IUPAC2-chloro-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide
SMILESO=S(=O)(NCc1cccs1)c1c(Cl)nc2ccccn12
InChIInChI=1S/C12H10ClN3O2S2/c13-11-12(16-6-2-1-5-10(16)15-11)20(17,18)14-8-9-4-3-7-19-9/h1-7,14H,8H2
InChIKeyJREZSVKOYANYED-UHFFFAOYSA-N
MW327.82 g/mol
LogP2.53
Rot. Bonds4

About 2-chloro-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide

2-chloro-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide (PubChem CID 47254419) has the molecular formula C12H10ClN3O2S2 and a molecular weight of 327.82 g/mol. Its IUPAC name is 2-chloro-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-chloro-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide
PubChem CID47254419
Molecular FormulaC12H10ClN3O2S2
Molecular Weight327.82 g/mol
Exact Mass326.99
IUPAC Name2-chloro-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide
SMILESO=S(=O)(NCc1cccs1)c1c(Cl)nc2ccccn12
InChIInChI=1S/C12H10ClN3O2S2/c13-11-12(16-6-2-1-5-10(16)15-11)20(17,18)14-8-9-4-3-7-19-9/h1-7,14H,8H2
InChIKeyJREZSVKOYANYED-UHFFFAOYSA-N
XLogP2.53
TPSA63.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.82
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The IUPAC name of 2-chloro-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide (CID 47254419) is 2-chloro-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide.
What is the SMILES notation for 2-chloro-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The canonical SMILES for 2-chloro-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide is O=S(=O)(NCc1cccs1)c1c(Cl)nc2ccccn12.
What is the InChIKey of 2-chloro-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The InChIKey is JREZSVKOYANYED-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClN3O2S2/c13-11-12(16-6-2-1-5-10(16)15-11)20(17,18)14-8-9-4-3-7-19-9/h1-7,14H,8H2.
What are the key properties of 2-chloro-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide?
2-chloro-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide has a molecular weight of 327.82 g/mol, XLogP of 2.53, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide is sourced from PubChem (CID 47254419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).