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

C16H11ClN4O2S2 — CID 91423127

IUPAC5-chloro-N-[4-(3H-imidazo[4,5-c]pyridin-2-yl)phenyl]thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1ccc(-c2nc3ccncc3[nH]2)cc1)c1ccc(Cl)s1
InChIInChI=1S/C16H11ClN4O2S2/c17-14-5-6-15(24-14)25(22,23)21-11-3-1-10(2-4-11)16-19-12-7-8-18-9-13(12)20-16/h1-9,21H,(H,19,20)
InChIKeyINAMLBGXFIGOSC-UHFFFAOYSA-N
MW390.88 g/mol
LogP4.14
Rot. Bonds4

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

5-chloro-N-[4-(3H-imidazo[4,5-c]pyridin-2-yl)phenyl]thiophene-2-sulfonamide (PubChem CID 91423127) has the molecular formula C16H11ClN4O2S2 and a molecular weight of 390.88 g/mol. Its IUPAC name is 5-chloro-N-[4-(3H-imidazo[4,5-c]pyridin-2-yl)phenyl]thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-[4-(3H-imidazo[4,5-c]pyridin-2-yl)phenyl]thiophene-2-sulfonamide
PubChem CID91423127
Molecular FormulaC16H11ClN4O2S2
Molecular Weight390.88 g/mol
Exact Mass390.00
IUPAC Name5-chloro-N-[4-(3H-imidazo[4,5-c]pyridin-2-yl)phenyl]thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1ccc(-c2nc3ccncc3[nH]2)cc1)c1ccc(Cl)s1
InChIInChI=1S/C16H11ClN4O2S2/c17-14-5-6-15(24-14)25(22,23)21-11-3-1-10(2-4-11)16-19-12-7-8-18-9-13(12)20-16/h1-9,21H,(H,19,20)
InChIKeyINAMLBGXFIGOSC-UHFFFAOYSA-N
XLogP4.14
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.88
LogP ≤ 54.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-chloro-N-[4-(3H-imidazo[4,5-c]pyridin-2-yl)phenyl]thiophene-3-carboxamide
CID 155963164
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5-chloro-N-(1H-indazol-6-yl)thiophene-2-sulfonamide
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5-chloro-N-(2-pyridin-4-yl-3H-benzimidazol-5-yl)thiophene-2-carboxamide
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5-chloro-N-pyrazin-2-ylthiophene-2-sulfonamide
CID 22772898
5-chloro-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)thiophene-2-sulfonamide
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N-(6-amino-3-pyridinyl)-5-chlorothiophene-2-sulfonamide
CID 55025745
4-[4-(3H-imidazo[4,5-c]pyridin-2-yl)phenyl]benzoic acid
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5-chloro-N-[3-(1H-imidazol-2-yl)phenyl]thiophene-2-sulfonamide
CID 110726466
4-methyl-N-(2-pyridin-4-yl-3H-benzimidazol-5-yl)benzenesulfonamide
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N-[2-[(5-chlorothiophen-2-yl)sulfonylamino]-3H-benzimidazol-5-yl]benzamide
CID 10113684

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[4-(3H-imidazo[4,5-c]pyridin-2-yl)phenyl]thiophene-2-sulfonamide?
The IUPAC name of 5-chloro-N-[4-(3H-imidazo[4,5-c]pyridin-2-yl)phenyl]thiophene-2-sulfonamide (CID 91423127) is 5-chloro-N-[4-(3H-imidazo[4,5-c]pyridin-2-yl)phenyl]thiophene-2-sulfonamide.
What is the SMILES notation for 5-chloro-N-[4-(3H-imidazo[4,5-c]pyridin-2-yl)phenyl]thiophene-2-sulfonamide?
The canonical SMILES for 5-chloro-N-[4-(3H-imidazo[4,5-c]pyridin-2-yl)phenyl]thiophene-2-sulfonamide is O=S(=O)(Nc1ccc(-c2nc3ccncc3[nH]2)cc1)c1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N-[4-(3H-imidazo[4,5-c]pyridin-2-yl)phenyl]thiophene-2-sulfonamide?
The InChIKey is INAMLBGXFIGOSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11ClN4O2S2/c17-14-5-6-15(24-14)25(22,23)21-11-3-1-10(2-4-11)16-19-12-7-8-18-9-13(12)20-16/h1-9,21H,(H,19,20).
What are the key properties of 5-chloro-N-[4-(3H-imidazo[4,5-c]pyridin-2-yl)phenyl]thiophene-2-sulfonamide?
5-chloro-N-[4-(3H-imidazo[4,5-c]pyridin-2-yl)phenyl]thiophene-2-sulfonamide has a molecular weight of 390.88 g/mol, XLogP of 4.14, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[4-(3H-imidazo[4,5-c]pyridin-2-yl)phenyl]thiophene-2-sulfonamide is sourced from PubChem (CID 91423127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).