5-chloro-N-(2-fluoro-4-hydroxyphenyl)thiophene-2-sulfonamide

C10H7ClFNO3S2 — CID 64786901

IUPAC5-chloro-N-(2-fluoro-4-hydroxyphenyl)thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1ccc(O)cc1F)c1ccc(Cl)s1
InChIInChI=1S/C10H7ClFNO3S2/c11-9-3-4-10(17-9)18(15,16)13-8-2-1-6(14)5-7(8)12/h1-5,13-14H
InChIKeyYMCVSSBRSXKECX-UHFFFAOYSA-N
MW307.76 g/mol
LogP3.05
Rot. Bonds3

About 5-chloro-N-(2-fluoro-4-hydroxyphenyl)thiophene-2-sulfonamide

5-chloro-N-(2-fluoro-4-hydroxyphenyl)thiophene-2-sulfonamide (PubChem CID 64786901) has the molecular formula C10H7ClFNO3S2 and a molecular weight of 307.76 g/mol. Its IUPAC name is 5-chloro-N-(2-fluoro-4-hydroxyphenyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-(2-fluoro-4-hydroxyphenyl)thiophene-2-sulfonamide
PubChem CID64786901
Molecular FormulaC10H7ClFNO3S2
Molecular Weight307.76 g/mol
Exact Mass306.95
IUPAC Name5-chloro-N-(2-fluoro-4-hydroxyphenyl)thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1ccc(O)cc1F)c1ccc(Cl)s1
InChIInChI=1S/C10H7ClFNO3S2/c11-9-3-4-10(17-9)18(15,16)13-8-2-1-6(14)5-7(8)12/h1-5,13-14H
InChIKeyYMCVSSBRSXKECX-UHFFFAOYSA-N
XLogP3.05
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.76
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'sulfonamide_B(41)', 'substructure': 'N/A'}, {'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

N-(2-fluoro-4-hydroxyphenyl)-5-methylthiophene-2-sulfonamide
CID 64786506
5-cyano-N-(2-fluoro-4-hydroxyphenyl)thiophene-2-sulfonamide
CID 106272305
5-chloro-N-(4-chloro-2-hydroxyphenyl)thiophene-2-sulfonamide
CID 81434366
5-chloro-N-(2,4-dibromophenyl)thiophene-2-sulfonamide
CID 4845679
N-(2-fluoro-4-hydroxyphenyl)methanesulfonamide
CID 64786305
N-(2-amino-4-methylphenyl)-5-chlorothiophene-2-sulfonamide
CID 43259125
5-chloro-N-(5-ethyl-2-hydroxyphenyl)thiophene-2-sulfonamide
CID 79209856
2-[(5-chlorothiophen-2-yl)sulfonylamino]-N-(2,4-difluorophenyl)acetamide
CID 113000885
N-[2-[(5-chlorothiophen-2-yl)sulfonylamino]-4-fluorophenyl]-N-methylacetamide
CID 113092899
4-chloro-2-[(5-chlorothiophen-2-yl)sulfonylamino]-N'-hydroxybenzenecarboximidamide
CID 77050384
3-[(5-chlorothiophen-2-yl)sulfonylamino]thiophene-2-carboxylic acid
CID 43443028
4-bromo-2-[(5-chlorothiophen-2-yl)sulfonylamino]benzoic acid
CID 60916262

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2-fluoro-4-hydroxyphenyl)thiophene-2-sulfonamide?
The IUPAC name of 5-chloro-N-(2-fluoro-4-hydroxyphenyl)thiophene-2-sulfonamide (CID 64786901) is 5-chloro-N-(2-fluoro-4-hydroxyphenyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-chloro-N-(2-fluoro-4-hydroxyphenyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-chloro-N-(2-fluoro-4-hydroxyphenyl)thiophene-2-sulfonamide is O=S(=O)(Nc1ccc(O)cc1F)c1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N-(2-fluoro-4-hydroxyphenyl)thiophene-2-sulfonamide?
The InChIKey is YMCVSSBRSXKECX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7ClFNO3S2/c11-9-3-4-10(17-9)18(15,16)13-8-2-1-6(14)5-7(8)12/h1-5,13-14H.
What are the key properties of 5-chloro-N-(2-fluoro-4-hydroxyphenyl)thiophene-2-sulfonamide?
5-chloro-N-(2-fluoro-4-hydroxyphenyl)thiophene-2-sulfonamide has a molecular weight of 307.76 g/mol, XLogP of 3.05, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2-fluoro-4-hydroxyphenyl)thiophene-2-sulfonamide is sourced from PubChem (CID 64786901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).