N-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]thiophene-2-sulfonamide

C16H12N4O2S2 — CID 59243189

IUPACN-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1cccc(-c2nc3ncccc3[nH]2)c1)c1cccs1
InChIInChI=1S/C16H12N4O2S2/c21-24(22,14-7-3-9-23-14)20-12-5-1-4-11(10-12)15-18-13-6-2-8-17-16(13)19-15/h1-10,20H,(H,17,18,19)
InChIKeyWWSHRTATUUNFTE-UHFFFAOYSA-N
MW356.43 g/mol
LogP3.49
Rot. Bonds4

About N-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]thiophene-2-sulfonamide

N-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]thiophene-2-sulfonamide (PubChem CID 59243189) has the molecular formula C16H12N4O2S2 and a molecular weight of 356.43 g/mol. Its IUPAC name is N-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]thiophene-2-sulfonamide
PubChem CID59243189
Molecular FormulaC16H12N4O2S2
Molecular Weight356.43 g/mol
Exact Mass356.04
IUPAC NameN-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1cccc(-c2nc3ncccc3[nH]2)c1)c1cccs1
InChIInChI=1S/C16H12N4O2S2/c21-24(22,14-7-3-9-23-14)20-12-5-1-4-11(10-12)15-18-13-6-2-8-17-16(13)19-15/h1-10,20H,(H,17,18,19)
InChIKeyWWSHRTATUUNFTE-UHFFFAOYSA-N
XLogP3.49
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-(5-methyl-2-oxo-3H-1,3-thiazol-4-yl)phenyl]thiophene-2-sulfonamide
CID 77106135
N-[5-(1H-imidazo[4,5-b]pyrazin-2-yl)-2-methoxyphenyl]thiophene-2-sulfonamide
CID 10157032
N-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]-3-methoxypropanamide
CID 91012537
N-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]thiophene-2-sulfonamide
CID 71229061
N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-sulfonamide
CID 7553601
N-[3-(1,3-thiazol-2-yl)phenyl]-3-(thiophen-2-ylsulfonylamino)benzamide
CID 55991234
N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)thiophene-2-sulfonamide
CID 122283303
N-[4-[3-(thiophen-2-ylsulfonylamino)phenyl]-1,3-thiazol-2-yl]acetamide
CID 155557473
N-[3-(pyridin-2-ylmethoxy)phenyl]thiophene-2-sulfonamide
CID 39839792
N-[3-(6-propoxypyridazin-3-yl)phenyl]thiophene-2-sulfonamide
CID 7524020
N-[3-(1H-benzimidazol-2-yl)phenyl]-4-bromobenzenesulfonamide
CID 100580950
N-(3-nitrophenyl)thiophene-2-sulfonamide
CID 768865

Frequently Asked Questions

What is the IUPAC name of N-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]thiophene-2-sulfonamide?
The IUPAC name of N-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]thiophene-2-sulfonamide (CID 59243189) is N-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]thiophene-2-sulfonamide.
What is the SMILES notation for N-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]thiophene-2-sulfonamide?
The canonical SMILES for N-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]thiophene-2-sulfonamide is O=S(=O)(Nc1cccc(-c2nc3ncccc3[nH]2)c1)c1cccs1.
What is the InChIKey of N-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]thiophene-2-sulfonamide?
The InChIKey is WWSHRTATUUNFTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N4O2S2/c21-24(22,14-7-3-9-23-14)20-12-5-1-4-11(10-12)15-18-13-6-2-8-17-16(13)19-15/h1-10,20H,(H,17,18,19).
What are the key properties of N-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]thiophene-2-sulfonamide?
N-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]thiophene-2-sulfonamide has a molecular weight of 356.43 g/mol, XLogP of 3.49, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]thiophene-2-sulfonamide is sourced from PubChem (CID 59243189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).