5-bromo-4-chloro-N-(3,5-dichloro-6-methyl-2-pyridinyl)thiophene-2-sulfonamide

C10H6BrCl3N2O2S2 — CID 80579960

IUPAC5-bromo-4-chloro-N-(3,5-dichloro-6-methyl-2-pyridinyl)thiophene-2-sulfonamide
SMILESCc1nc(NS(=O)(=O)c2cc(Cl)c(Br)s2)c(Cl)cc1Cl
InChIInChI=1S/C10H6BrCl3N2O2S2/c1-4-5(12)2-7(14)10(15-4)16-20(17,18)8-3-6(13)9(11)19-8/h2-3H,1H3,(H,15,16)
InChIKeyUMYNPDIQMGEXQN-UHFFFAOYSA-N
MW436.57 g/mol
LogP4.98
Rot. Bonds3

About 5-bromo-4-chloro-N-(3,5-dichloro-6-methyl-2-pyridinyl)thiophene-2-sulfonamide

5-bromo-4-chloro-N-(3,5-dichloro-6-methyl-2-pyridinyl)thiophene-2-sulfonamide (PubChem CID 80579960) has the molecular formula C10H6BrCl3N2O2S2 and a molecular weight of 436.57 g/mol. Its IUPAC name is 5-bromo-4-chloro-N-(3,5-dichloro-6-methyl-2-pyridinyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-bromo-4-chloro-N-(3,5-dichloro-6-methyl-2-pyridinyl)thiophene-2-sulfonamide
PubChem CID80579960
Molecular FormulaC10H6BrCl3N2O2S2
Molecular Weight436.57 g/mol
Exact Mass433.81
IUPAC Name5-bromo-4-chloro-N-(3,5-dichloro-6-methyl-2-pyridinyl)thiophene-2-sulfonamide
SMILESCc1nc(NS(=O)(=O)c2cc(Cl)c(Br)s2)c(Cl)cc1Cl
InChIInChI=1S/C10H6BrCl3N2O2S2/c1-4-5(12)2-7(14)10(15-4)16-20(17,18)8-3-6(13)9(11)19-8/h2-3H,1H3,(H,15,16)
InChIKeyUMYNPDIQMGEXQN-UHFFFAOYSA-N
XLogP4.98
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.57
LogP ≤ 54.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-bromo-4-chloro-N-(3,5-dichloro-6-methyl-2-pyridinyl)thiophene-2-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-bromo-4-chloro-N-(3,5-dichloro-6-methyl-2-pyridinyl)thiophene-2-sulfonamide?
The IUPAC name of 5-bromo-4-chloro-N-(3,5-dichloro-6-methyl-2-pyridinyl)thiophene-2-sulfonamide (CID 80579960) is 5-bromo-4-chloro-N-(3,5-dichloro-6-methyl-2-pyridinyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-bromo-4-chloro-N-(3,5-dichloro-6-methyl-2-pyridinyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-bromo-4-chloro-N-(3,5-dichloro-6-methyl-2-pyridinyl)thiophene-2-sulfonamide is Cc1nc(NS(=O)(=O)c2cc(Cl)c(Br)s2)c(Cl)cc1Cl.
What is the InChIKey of 5-bromo-4-chloro-N-(3,5-dichloro-6-methyl-2-pyridinyl)thiophene-2-sulfonamide?
The InChIKey is UMYNPDIQMGEXQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6BrCl3N2O2S2/c1-4-5(12)2-7(14)10(15-4)16-20(17,18)8-3-6(13)9(11)19-8/h2-3H,1H3,(H,15,16).
What are the key properties of 5-bromo-4-chloro-N-(3,5-dichloro-6-methyl-2-pyridinyl)thiophene-2-sulfonamide?
5-bromo-4-chloro-N-(3,5-dichloro-6-methyl-2-pyridinyl)thiophene-2-sulfonamide has a molecular weight of 436.57 g/mol, XLogP of 4.98, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4-chloro-N-(3,5-dichloro-6-methyl-2-pyridinyl)thiophene-2-sulfonamide is sourced from PubChem (CID 80579960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).