2-chloro-N-(2,2-difluoroethyl)-4-methyl-1,3-thiazole-5-sulfonamide

C6H7ClF2N2O2S2 — CID 79477674

IUPAC2-chloro-N-(2,2-difluoroethyl)-4-methyl-1,3-thiazole-5-sulfonamide
SMILESCc1nc(Cl)sc1S(=O)(=O)NCC(F)F
InChIInChI=1S/C6H7ClF2N2O2S2/c1-3-5(14-6(7)11-3)15(12,13)10-2-4(8)9/h4,10H,2H2,1H3
InChIKeyKQUOEAOYSPUVQU-UHFFFAOYSA-N
MW276.72 g/mol
LogP1.65
Rot. Bonds4

About 2-chloro-N-(2,2-difluoroethyl)-4-methyl-1,3-thiazole-5-sulfonamide

2-chloro-N-(2,2-difluoroethyl)-4-methyl-1,3-thiazole-5-sulfonamide (PubChem CID 79477674) has the molecular formula C6H7ClF2N2O2S2 and a molecular weight of 276.72 g/mol. Its IUPAC name is 2-chloro-N-(2,2-difluoroethyl)-4-methyl-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound Name2-chloro-N-(2,2-difluoroethyl)-4-methyl-1,3-thiazole-5-sulfonamide
PubChem CID79477674
Molecular FormulaC6H7ClF2N2O2S2
Molecular Weight276.72 g/mol
Exact Mass275.96
IUPAC Name2-chloro-N-(2,2-difluoroethyl)-4-methyl-1,3-thiazole-5-sulfonamide
SMILESCc1nc(Cl)sc1S(=O)(=O)NCC(F)F
InChIInChI=1S/C6H7ClF2N2O2S2/c1-3-5(14-6(7)11-3)15(12,13)10-2-4(8)9/h4,10H,2H2,1H3
InChIKeyKQUOEAOYSPUVQU-UHFFFAOYSA-N
XLogP1.65
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.72
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-chloro-N-(2,2-difluoroethyl)-4-methyl-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

Related Compounds

2-Chloro-4-methyl-1,3-thiazole-5-sulfonamide
CID 12094251
2-chloro-N-(2-fluorocyclopropyl)-4-methyl-1,3-thiazole-5-sulfonamide
CID 60127658
2-chloro-N-(1-fluorocyclopropyl)-4-methyl-1,3-thiazole-5-sulfonamide
CID 69846931
2-chloro-4-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-sulfonamide
CID 43456163
2-chloro-N-ethyl-4-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-sulfonamide
CID 55010751
2-chloro-N-cyclopropyl-4-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-sulfonamide
CID 55010802
2-chloro-4-methyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]-1,3-thiazole-5-sulfonamide
CID 55261076
2-chloro-N,4-dimethyl-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-sulfonamide
CID 60891755
2-chloro-4-methyl-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-sulfonamide
CID 61045044
2-chloro-4-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-sulfonamide
CID 61045590
N-butyl-2-chloro-4-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-sulfonamide
CID 61046129
2-chloro-4-methyl-N-propyl-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-sulfonamide
CID 61046497

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(2,2-difluoroethyl)-4-methyl-1,3-thiazole-5-sulfonamide?
The IUPAC name of 2-chloro-N-(2,2-difluoroethyl)-4-methyl-1,3-thiazole-5-sulfonamide (CID 79477674) is 2-chloro-N-(2,2-difluoroethyl)-4-methyl-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for 2-chloro-N-(2,2-difluoroethyl)-4-methyl-1,3-thiazole-5-sulfonamide?
The canonical SMILES for 2-chloro-N-(2,2-difluoroethyl)-4-methyl-1,3-thiazole-5-sulfonamide is Cc1nc(Cl)sc1S(=O)(=O)NCC(F)F.
What is the InChIKey of 2-chloro-N-(2,2-difluoroethyl)-4-methyl-1,3-thiazole-5-sulfonamide?
The InChIKey is KQUOEAOYSPUVQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7ClF2N2O2S2/c1-3-5(14-6(7)11-3)15(12,13)10-2-4(8)9/h4,10H,2H2,1H3.
What are the key properties of 2-chloro-N-(2,2-difluoroethyl)-4-methyl-1,3-thiazole-5-sulfonamide?
2-chloro-N-(2,2-difluoroethyl)-4-methyl-1,3-thiazole-5-sulfonamide has a molecular weight of 276.72 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(2,2-difluoroethyl)-4-methyl-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 79477674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).