2-[(5-chloro-2-fluorophenyl)methoxy]-5-fluorobenzenesulfonamide

C13H10ClF2NO3S — CID 103047119

IUPAC2-[(5-chloro-2-fluorophenyl)methoxy]-5-fluorobenzenesulfonamide
SMILESNS(=O)(=O)c1cc(F)ccc1OCc1cc(Cl)ccc1F
InChIInChI=1S/C13H10ClF2NO3S/c14-9-1-3-11(16)8(5-9)7-20-12-4-2-10(15)6-13(12)21(17,18)19/h1-6H,7H2,(H2,17,18,19)
InChIKeyYLTQAUQZWIPKNU-UHFFFAOYSA-N
MW333.74 g/mol
LogP2.84
Rot. Bonds4

About 2-[(5-chloro-2-fluorophenyl)methoxy]-5-fluorobenzenesulfonamide

2-[(5-chloro-2-fluorophenyl)methoxy]-5-fluorobenzenesulfonamide (PubChem CID 103047119) has the molecular formula C13H10ClF2NO3S and a molecular weight of 333.74 g/mol. Its IUPAC name is 2-[(5-chloro-2-fluorophenyl)methoxy]-5-fluorobenzenesulfonamide.

Molecular Properties

Compound Name2-[(5-chloro-2-fluorophenyl)methoxy]-5-fluorobenzenesulfonamide
PubChem CID103047119
Molecular FormulaC13H10ClF2NO3S
Molecular Weight333.74 g/mol
Exact Mass333.00
IUPAC Name2-[(5-chloro-2-fluorophenyl)methoxy]-5-fluorobenzenesulfonamide
SMILESNS(=O)(=O)c1cc(F)ccc1OCc1cc(Cl)ccc1F
InChIInChI=1S/C13H10ClF2NO3S/c14-9-1-3-11(16)8(5-9)7-20-12-4-2-10(15)6-13(12)21(17,18)19/h1-6H,7H2,(H2,17,18,19)
InChIKeyYLTQAUQZWIPKNU-UHFFFAOYSA-N
XLogP2.84
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.74
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[(5-chloro-2-fluorophenyl)methoxy]-5-fluorobenzenesulfonamide 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-[(4-chlorophenyl)methoxy]-5-fluorobenzenesulfonamide
CID 62105360
5-fluoro-2-[(2-methoxyphenyl)methoxy]benzenesulfonamide
CID 62104803
2-(bromomethyl)-1-[(5-chloro-2-fluorophenyl)methoxy]-4-fluorobenzene
CID 107698978
2-[(4-fluoro-2-methylphenyl)methoxy]-5-methylbenzenesulfonamide
CID 114346410
2-[(2,4-dichlorophenyl)methoxy]-5-methylbenzenesulfonamide
CID 43342438
1-[2-[(5-chloro-2-fluorophenyl)methoxy]-5-fluorophenyl]ethanone
CID 103046643
5-fluoro-2-(3-fluoropropoxy)benzenesulfonamide
CID 81113508
2-(4-fluoro-2-sulfamoylphenoxy)acetic acid
CID 62103698
5-chloro-2-[(2-fluorophenyl)methoxy]benzenesulfonyl chloride
CID 62103692
2-[(2-bromo-4-fluorophenyl)methoxy]-5-fluorobenzenesulfonyl chloride
CID 62104790
2-[(2-chloro-3-fluorophenyl)methoxy]-5-methylbenzenesulfonamide
CID 115983170
2-(3,3-dimethylbutoxy)-5-fluorobenzenesulfonamide
CID 62105180

Frequently Asked Questions

What is the IUPAC name of 2-[(5-chloro-2-fluorophenyl)methoxy]-5-fluorobenzenesulfonamide?
The IUPAC name of 2-[(5-chloro-2-fluorophenyl)methoxy]-5-fluorobenzenesulfonamide (CID 103047119) is 2-[(5-chloro-2-fluorophenyl)methoxy]-5-fluorobenzenesulfonamide.
What is the SMILES notation for 2-[(5-chloro-2-fluorophenyl)methoxy]-5-fluorobenzenesulfonamide?
The canonical SMILES for 2-[(5-chloro-2-fluorophenyl)methoxy]-5-fluorobenzenesulfonamide is NS(=O)(=O)c1cc(F)ccc1OCc1cc(Cl)ccc1F.
What is the InChIKey of 2-[(5-chloro-2-fluorophenyl)methoxy]-5-fluorobenzenesulfonamide?
The InChIKey is YLTQAUQZWIPKNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10ClF2NO3S/c14-9-1-3-11(16)8(5-9)7-20-12-4-2-10(15)6-13(12)21(17,18)19/h1-6H,7H2,(H2,17,18,19).
What are the key properties of 2-[(5-chloro-2-fluorophenyl)methoxy]-5-fluorobenzenesulfonamide?
2-[(5-chloro-2-fluorophenyl)methoxy]-5-fluorobenzenesulfonamide has a molecular weight of 333.74 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-chloro-2-fluorophenyl)methoxy]-5-fluorobenzenesulfonamide is sourced from PubChem (CID 103047119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).