2-chloro-N-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-sulfonamide

C10H5ClF4N2O2S2 — CID 61229017

IUPAC2-chloro-N-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-sulfonamide
SMILESO=S(=O)(Nc1ccc(F)c(C(F)(F)F)c1)c1cnc(Cl)s1
InChIInChI=1S/C10H5ClF4N2O2S2/c11-9-16-4-8(20-9)21(18,19)17-5-1-2-7(12)6(3-5)10(13,14)15/h1-4,17H
InChIKeyLFWZMGPIMKOSHB-UHFFFAOYSA-N
MW360.74 g/mol
LogP3.76
Rot. Bonds3

About 2-chloro-N-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-sulfonamide

2-chloro-N-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-sulfonamide (PubChem CID 61229017) has the molecular formula C10H5ClF4N2O2S2 and a molecular weight of 360.74 g/mol. Its IUPAC name is 2-chloro-N-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound Name2-chloro-N-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-sulfonamide
PubChem CID61229017
Molecular FormulaC10H5ClF4N2O2S2
Molecular Weight360.74 g/mol
Exact Mass359.94
IUPAC Name2-chloro-N-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-sulfonamide
SMILESO=S(=O)(Nc1ccc(F)c(C(F)(F)F)c1)c1cnc(Cl)s1
InChIInChI=1S/C10H5ClF4N2O2S2/c11-9-16-4-8(20-9)21(18,19)17-5-1-2-7(12)6(3-5)10(13,14)15/h1-4,17H
InChIKeyLFWZMGPIMKOSHB-UHFFFAOYSA-N
XLogP3.76
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.74
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-chloro-N-[4-fluoro-3-(trifluoromethyl)phenyl]-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-N-[3-chloro-5-(trifluoromethyl)phenyl]-1,3-thiazole-5-sulfonamide
CID 116699344
2-chloro-N-(3,5-dichloro-4-fluorophenyl)-1,3-thiazole-5-sulfonamide
CID 107573403
N-(4-bromophenyl)-2-chloro-1,3-thiazole-5-sulfonamide
CID 43427435
N-(4-bromo-2,6-difluorophenyl)-2-chloro-1,3-thiazole-5-sulfonamide
CID 65467042
2-chloro-N-(3-sulfamoylphenyl)-1,3-thiazole-5-sulfonamide
CID 43427451
4-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]-N,N-dimethylbenzamide
CID 60749460
3,5-dichloro-N-[4-fluoro-3-(trifluoromethyl)phenyl]-2-hydroxybenzenesulfonamide
CID 3751185
5-chloro-N-[4-methyl-3-(trifluoromethyl)phenyl]thiophene-2-sulfonamide
CID 24580783
N-[4-fluoro-3-(trifluoromethyl)phenyl]-5-methyl-1H-pyrazole-4-sulfonamide
CID 61228449
2-chloro-N-[[2-(trifluoromethyl)phenyl]methyl]-1,3-thiazole-5-sulfonamide
CID 62880621
2-chloro-N-(5-fluoro-2-methylphenyl)-1,3-thiazole-5-sulfonamide
CID 43427475
N-(4-butan-2-ylphenyl)-2-chloro-1,3-thiazole-5-sulfonamide
CID 61051227

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-sulfonamide?
The IUPAC name of 2-chloro-N-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-sulfonamide (CID 61229017) is 2-chloro-N-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for 2-chloro-N-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-sulfonamide?
The canonical SMILES for 2-chloro-N-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-sulfonamide is O=S(=O)(Nc1ccc(F)c(C(F)(F)F)c1)c1cnc(Cl)s1.
What is the InChIKey of 2-chloro-N-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-sulfonamide?
The InChIKey is LFWZMGPIMKOSHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5ClF4N2O2S2/c11-9-16-4-8(20-9)21(18,19)17-5-1-2-7(12)6(3-5)10(13,14)15/h1-4,17H.
What are the key properties of 2-chloro-N-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-sulfonamide?
2-chloro-N-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-sulfonamide has a molecular weight of 360.74 g/mol, XLogP of 3.76, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 61229017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).