5-chloro-N-(2,4-dibromophenyl)thiophene-2-sulfonamide

C10H6Br2ClNO2S2 — CID 4845679

IUPAC5-chloro-N-(2,4-dibromophenyl)thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1ccc(Br)cc1Br)c1ccc(Cl)s1
InChIInChI=1S/C10H6Br2ClNO2S2/c11-6-1-2-8(7(12)5-6)14-18(15,16)10-4-3-9(13)17-10/h1-5,14H
InChIKeyVQVVWMPPLRZMAT-UHFFFAOYSA-N
MW431.56 g/mol
LogP4.73
Rot. Bonds3

About 5-chloro-N-(2,4-dibromophenyl)thiophene-2-sulfonamide

5-chloro-N-(2,4-dibromophenyl)thiophene-2-sulfonamide (PubChem CID 4845679) has the molecular formula C10H6Br2ClNO2S2 and a molecular weight of 431.56 g/mol. Its IUPAC name is 5-chloro-N-(2,4-dibromophenyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-(2,4-dibromophenyl)thiophene-2-sulfonamide
PubChem CID4845679
Molecular FormulaC10H6Br2ClNO2S2
Molecular Weight431.56 g/mol
Exact Mass428.79
IUPAC Name5-chloro-N-(2,4-dibromophenyl)thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1ccc(Br)cc1Br)c1ccc(Cl)s1
InChIInChI=1S/C10H6Br2ClNO2S2/c11-6-1-2-8(7(12)5-6)14-18(15,16)10-4-3-9(13)17-10/h1-5,14H
InChIKeyVQVVWMPPLRZMAT-UHFFFAOYSA-N
XLogP4.73
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.56
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2,4-dibromophenyl)thiophene-2-sulfonamide?
The IUPAC name of 5-chloro-N-(2,4-dibromophenyl)thiophene-2-sulfonamide (CID 4845679) is 5-chloro-N-(2,4-dibromophenyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-chloro-N-(2,4-dibromophenyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-chloro-N-(2,4-dibromophenyl)thiophene-2-sulfonamide is O=S(=O)(Nc1ccc(Br)cc1Br)c1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N-(2,4-dibromophenyl)thiophene-2-sulfonamide?
The InChIKey is VQVVWMPPLRZMAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Br2ClNO2S2/c11-6-1-2-8(7(12)5-6)14-18(15,16)10-4-3-9(13)17-10/h1-5,14H.
What are the key properties of 5-chloro-N-(2,4-dibromophenyl)thiophene-2-sulfonamide?
5-chloro-N-(2,4-dibromophenyl)thiophene-2-sulfonamide has a molecular weight of 431.56 g/mol, XLogP of 4.73, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2,4-dibromophenyl)thiophene-2-sulfonamide is sourced from PubChem (CID 4845679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).