2-chloro-N-propyl-1,3-thiazole-5-sulfonamide

C6H9ClN2O2S2 — CID 43455767

IUPAC2-chloro-N-propyl-1,3-thiazole-5-sulfonamide
SMILESCCCNS(=O)(=O)c1cnc(Cl)s1
InChIInChI=1S/C6H9ClN2O2S2/c1-2-3-9-13(10,11)5-4-8-6(7)12-5/h4,9H,2-3H2,1H3
InChIKeyUZAXOLNLLXWACN-UHFFFAOYSA-N
MW240.74 g/mol
LogP1.48
Rot. Bonds4

About 2-chloro-N-propyl-1,3-thiazole-5-sulfonamide

2-chloro-N-propyl-1,3-thiazole-5-sulfonamide (PubChem CID 43455767) has the molecular formula C6H9ClN2O2S2 and a molecular weight of 240.74 g/mol. Its IUPAC name is 2-chloro-N-propyl-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound Name2-chloro-N-propyl-1,3-thiazole-5-sulfonamide
PubChem CID43455767
Molecular FormulaC6H9ClN2O2S2
Molecular Weight240.74 g/mol
Exact Mass239.98
IUPAC Name2-chloro-N-propyl-1,3-thiazole-5-sulfonamide
SMILESCCCNS(=O)(=O)c1cnc(Cl)s1
InChIInChI=1S/C6H9ClN2O2S2/c1-2-3-9-13(10,11)5-4-8-6(7)12-5/h4,9H,2-3H2,1H3
InChIKeyUZAXOLNLLXWACN-UHFFFAOYSA-N
XLogP1.48
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.74
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-chloro-N-propyl-1,3-thiazole-5-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 2-chloro-N-propyl-1,3-thiazole-5-sulfonamide?
The IUPAC name of 2-chloro-N-propyl-1,3-thiazole-5-sulfonamide (CID 43455767) is 2-chloro-N-propyl-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for 2-chloro-N-propyl-1,3-thiazole-5-sulfonamide?
The canonical SMILES for 2-chloro-N-propyl-1,3-thiazole-5-sulfonamide is CCCNS(=O)(=O)c1cnc(Cl)s1.
What is the InChIKey of 2-chloro-N-propyl-1,3-thiazole-5-sulfonamide?
The InChIKey is UZAXOLNLLXWACN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9ClN2O2S2/c1-2-3-9-13(10,11)5-4-8-6(7)12-5/h4,9H,2-3H2,1H3.
What are the key properties of 2-chloro-N-propyl-1,3-thiazole-5-sulfonamide?
2-chloro-N-propyl-1,3-thiazole-5-sulfonamide has a molecular weight of 240.74 g/mol, XLogP of 1.48, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-propyl-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 43455767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).