5-chloro-N-(2,5-difluorophenyl)-1-methylimidazole-4-sulfonamide

C10H8ClF2N3O2S — CID 43415175

IUPAC5-chloro-N-(2,5-difluorophenyl)-1-methylimidazole-4-sulfonamide
SMILESCn1cnc(S(=O)(=O)Nc2cc(F)ccc2F)c1Cl
InChIInChI=1S/C10H8ClF2N3O2S/c1-16-5-14-10(9(16)11)19(17,18)15-8-4-6(12)2-3-7(8)13/h2-5,15H,1H3
InChIKeyCBSGHGDXBJDVFN-UHFFFAOYSA-N
MW307.71 g/mol
LogP2.15
Rot. Bonds3

About 5-chloro-N-(2,5-difluorophenyl)-1-methylimidazole-4-sulfonamide

5-chloro-N-(2,5-difluorophenyl)-1-methylimidazole-4-sulfonamide (PubChem CID 43415175) has the molecular formula C10H8ClF2N3O2S and a molecular weight of 307.71 g/mol. Its IUPAC name is 5-chloro-N-(2,5-difluorophenyl)-1-methylimidazole-4-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-(2,5-difluorophenyl)-1-methylimidazole-4-sulfonamide
PubChem CID43415175
Molecular FormulaC10H8ClF2N3O2S
Molecular Weight307.71 g/mol
Exact Mass307.00
IUPAC Name5-chloro-N-(2,5-difluorophenyl)-1-methylimidazole-4-sulfonamide
SMILESCn1cnc(S(=O)(=O)Nc2cc(F)ccc2F)c1Cl
InChIInChI=1S/C10H8ClF2N3O2S/c1-16-5-14-10(9(16)11)19(17,18)15-8-4-6(12)2-3-7(8)13/h2-5,15H,1H3
InChIKeyCBSGHGDXBJDVFN-UHFFFAOYSA-N
XLogP2.15
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.71
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-N-(2-fluorophenyl)-1-methylimidazole-4-sulfonamide
CID 43415160
5-chloro-N-(2-fluoro-4-methylphenyl)-1-methylimidazole-4-sulfonamide
CID 43415195
N-(5-bromo-2,4-difluorophenyl)-5-chloro-1-methylimidazole-4-sulfonamide
CID 102846862
5-chloro-N-(3,5-difluorophenyl)-1-methylimidazole-4-sulfonamide
CID 43415229
5-chloro-N-(5-chloro-2-cyanophenyl)-1-methylimidazole-4-sulfonamide
CID 61051415
5-chloro-N-(2,3-dichlorophenyl)-1-methylimidazole-4-sulfonamide
CID 43456018
5-chloro-N-(2,4-dimethoxyphenyl)-1-methylimidazole-4-sulfonamide
CID 43415198
5-amino-N-(5-chloro-2-fluorophenyl)-3-methylimidazole-4-sulfonamide
CID 63979821
5-chloro-1-methyl-N-pyridin-4-ylimidazole-4-sulfonamide
CID 43455993
5-chloro-N-[3-[(4-fluorophenyl)methoxy]phenyl]-1-methylimidazole-4-sulfonamide
CID 134006766
5-chloro-1-methyl-N-(2-nitrophenyl)imidazole-4-sulfonamide
CID 61051631
5-chloro-N-[2-(4-fluorophenyl)-3H-benzimidazol-5-yl]-1-methylimidazole-4-sulfonamide
CID 42961971

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2,5-difluorophenyl)-1-methylimidazole-4-sulfonamide?
The IUPAC name of 5-chloro-N-(2,5-difluorophenyl)-1-methylimidazole-4-sulfonamide (CID 43415175) is 5-chloro-N-(2,5-difluorophenyl)-1-methylimidazole-4-sulfonamide.
What is the SMILES notation for 5-chloro-N-(2,5-difluorophenyl)-1-methylimidazole-4-sulfonamide?
The canonical SMILES for 5-chloro-N-(2,5-difluorophenyl)-1-methylimidazole-4-sulfonamide is Cn1cnc(S(=O)(=O)Nc2cc(F)ccc2F)c1Cl.
What is the InChIKey of 5-chloro-N-(2,5-difluorophenyl)-1-methylimidazole-4-sulfonamide?
The InChIKey is CBSGHGDXBJDVFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClF2N3O2S/c1-16-5-14-10(9(16)11)19(17,18)15-8-4-6(12)2-3-7(8)13/h2-5,15H,1H3.
What are the key properties of 5-chloro-N-(2,5-difluorophenyl)-1-methylimidazole-4-sulfonamide?
5-chloro-N-(2,5-difluorophenyl)-1-methylimidazole-4-sulfonamide has a molecular weight of 307.71 g/mol, XLogP of 2.15, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2,5-difluorophenyl)-1-methylimidazole-4-sulfonamide is sourced from PubChem (CID 43415175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).