3-bromo-N-(3-chloro-2-fluorophenyl)thiophene-2-sulfonamide

C10H6BrClFNO2S2 — CID 61063010

IUPAC3-bromo-N-(3-chloro-2-fluorophenyl)thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1cccc(Cl)c1F)c1sccc1Br
InChIInChI=1S/C10H6BrClFNO2S2/c11-6-4-5-17-10(6)18(15,16)14-8-3-1-2-7(12)9(8)13/h1-5,14H
InChIKeyGYWFHURCRVXTEQ-UHFFFAOYSA-N
MW370.65 g/mol
LogP4.10
Rot. Bonds3

About 3-bromo-N-(3-chloro-2-fluorophenyl)thiophene-2-sulfonamide

3-bromo-N-(3-chloro-2-fluorophenyl)thiophene-2-sulfonamide (PubChem CID 61063010) has the molecular formula C10H6BrClFNO2S2 and a molecular weight of 370.65 g/mol. Its IUPAC name is 3-bromo-N-(3-chloro-2-fluorophenyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name3-bromo-N-(3-chloro-2-fluorophenyl)thiophene-2-sulfonamide
PubChem CID61063010
Molecular FormulaC10H6BrClFNO2S2
Molecular Weight370.65 g/mol
Exact Mass368.87
IUPAC Name3-bromo-N-(3-chloro-2-fluorophenyl)thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1cccc(Cl)c1F)c1sccc1Br
InChIInChI=1S/C10H6BrClFNO2S2/c11-6-4-5-17-10(6)18(15,16)14-8-3-1-2-7(12)9(8)13/h1-5,14H
InChIKeyGYWFHURCRVXTEQ-UHFFFAOYSA-N
XLogP4.10
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.65
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-bromo-N-(3-chloro-2-fluorophenyl)thiophene-2-sulfonamide?
The IUPAC name of 3-bromo-N-(3-chloro-2-fluorophenyl)thiophene-2-sulfonamide (CID 61063010) is 3-bromo-N-(3-chloro-2-fluorophenyl)thiophene-2-sulfonamide.
What is the SMILES notation for 3-bromo-N-(3-chloro-2-fluorophenyl)thiophene-2-sulfonamide?
The canonical SMILES for 3-bromo-N-(3-chloro-2-fluorophenyl)thiophene-2-sulfonamide is O=S(=O)(Nc1cccc(Cl)c1F)c1sccc1Br.
What is the InChIKey of 3-bromo-N-(3-chloro-2-fluorophenyl)thiophene-2-sulfonamide?
The InChIKey is GYWFHURCRVXTEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6BrClFNO2S2/c11-6-4-5-17-10(6)18(15,16)14-8-3-1-2-7(12)9(8)13/h1-5,14H.
What are the key properties of 3-bromo-N-(3-chloro-2-fluorophenyl)thiophene-2-sulfonamide?
3-bromo-N-(3-chloro-2-fluorophenyl)thiophene-2-sulfonamide has a molecular weight of 370.65 g/mol, XLogP of 4.10, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-N-(3-chloro-2-fluorophenyl)thiophene-2-sulfonamide is sourced from PubChem (CID 61063010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).