2,4-difluoro-N-(1,3-thiazol-2-yl)benzenesulfonamide

C9H6F2N2O2S2 — CID 25038904

IUPAC2,4-difluoro-N-(1,3-thiazol-2-yl)benzenesulfonamide
SMILESO=S(=O)(Nc1nccs1)c1ccc(F)cc1F
InChIInChI=1S/C9H6F2N2O2S2/c10-6-1-2-8(7(11)5-6)17(14,15)13-9-12-3-4-16-9/h1-5H,(H,12,13)
InChIKeySJGNVHFLSMBIKC-UHFFFAOYSA-N
MW276.29 g/mol
LogP2.22
Rot. Bonds3

About 2,4-difluoro-N-(1,3-thiazol-2-yl)benzenesulfonamide

2,4-difluoro-N-(1,3-thiazol-2-yl)benzenesulfonamide (PubChem CID 25038904) has the molecular formula C9H6F2N2O2S2 and a molecular weight of 276.29 g/mol. Its IUPAC name is 2,4-difluoro-N-(1,3-thiazol-2-yl)benzenesulfonamide.

Molecular Properties

Compound Name2,4-difluoro-N-(1,3-thiazol-2-yl)benzenesulfonamide
PubChem CID25038904
Molecular FormulaC9H6F2N2O2S2
Molecular Weight276.29 g/mol
Exact Mass275.98
IUPAC Name2,4-difluoro-N-(1,3-thiazol-2-yl)benzenesulfonamide
SMILESO=S(=O)(Nc1nccs1)c1ccc(F)cc1F
InChIInChI=1S/C9H6F2N2O2S2/c10-6-1-2-8(7(11)5-6)17(14,15)13-9-12-3-4-16-9/h1-5H,(H,12,13)
InChIKeySJGNVHFLSMBIKC-UHFFFAOYSA-N
XLogP2.22
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.29
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Sulfathiazole
CID 5340
4-bromo-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide
CID 669304
N-(4-Thiazolin-2-ylidene)benzenesulfonamide
CID 236564
2-(benzenesulfonyl)-N-(1,3-thiazol-2-yl)acetamide
CID 2991996
4-Chloro-N-thiazol-2-yl-benzenesulfonamide
CID 306826
4-fluoro-N-(1,3-thiazol-2-yl)benzenesulfonamide
CID 676567
2,4,6-Trimethyl-N-thiazol-2-yl-benzenesulfonamide
CID 787582
2-((4-fluorophenyl)sulfonyl)-N-(thiazol-2-yl)acetamide
CID 7254486
2,5-dichloro-N-(1,3-thiazol-2-yl)benzenesulfonamide
CID 661093
4-Ethyl-N-2-thiazolylbenzenesulfonamide
CID 791527
1-phenyl-N-(1,3-thiazol-2-yl)methanesulfonamide
CID 743642
4-methyl-N-(1,3-thiazol-2-yl)benzenesulfonamide
CID 403570

Frequently Asked Questions

What is the IUPAC name of 2,4-difluoro-N-(1,3-thiazol-2-yl)benzenesulfonamide?
The IUPAC name of 2,4-difluoro-N-(1,3-thiazol-2-yl)benzenesulfonamide (CID 25038904) is 2,4-difluoro-N-(1,3-thiazol-2-yl)benzenesulfonamide.
What is the SMILES notation for 2,4-difluoro-N-(1,3-thiazol-2-yl)benzenesulfonamide?
The canonical SMILES for 2,4-difluoro-N-(1,3-thiazol-2-yl)benzenesulfonamide is O=S(=O)(Nc1nccs1)c1ccc(F)cc1F.
What is the InChIKey of 2,4-difluoro-N-(1,3-thiazol-2-yl)benzenesulfonamide?
The InChIKey is SJGNVHFLSMBIKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6F2N2O2S2/c10-6-1-2-8(7(11)5-6)17(14,15)13-9-12-3-4-16-9/h1-5H,(H,12,13).
What are the key properties of 2,4-difluoro-N-(1,3-thiazol-2-yl)benzenesulfonamide?
2,4-difluoro-N-(1,3-thiazol-2-yl)benzenesulfonamide has a molecular weight of 276.29 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-difluoro-N-(1,3-thiazol-2-yl)benzenesulfonamide is sourced from PubChem (CID 25038904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).