2,5-dichloro-N-(2-chloro-4-fluorophenyl)benzenesulfonamide

C12H7Cl3FNO2S — CID 26969901

IUPAC2,5-dichloro-N-(2-chloro-4-fluorophenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(F)cc1Cl)c1cc(Cl)ccc1Cl
InChIInChI=1S/C12H7Cl3FNO2S/c13-7-1-3-9(14)12(5-7)20(18,19)17-11-4-2-8(16)6-10(11)15/h1-6,17H
InChIKeyIGNVJECDSGQWMC-UHFFFAOYSA-N
MW354.62 g/mol
LogP4.59
Rot. Bonds3

About 2,5-dichloro-N-(2-chloro-4-fluorophenyl)benzenesulfonamide

2,5-dichloro-N-(2-chloro-4-fluorophenyl)benzenesulfonamide (PubChem CID 26969901) has the molecular formula C12H7Cl3FNO2S and a molecular weight of 354.62 g/mol. Its IUPAC name is 2,5-dichloro-N-(2-chloro-4-fluorophenyl)benzenesulfonamide.

Molecular Properties

Compound Name2,5-dichloro-N-(2-chloro-4-fluorophenyl)benzenesulfonamide
PubChem CID26969901
Molecular FormulaC12H7Cl3FNO2S
Molecular Weight354.62 g/mol
Exact Mass352.92
IUPAC Name2,5-dichloro-N-(2-chloro-4-fluorophenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(F)cc1Cl)c1cc(Cl)ccc1Cl
InChIInChI=1S/C12H7Cl3FNO2S/c13-7-1-3-9(14)12(5-7)20(18,19)17-11-4-2-8(16)6-10(11)15/h1-6,17H
InChIKeyIGNVJECDSGQWMC-UHFFFAOYSA-N
XLogP4.59
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.62
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,5-dichloro-N-(2,4-difluorophenyl)benzenesulfonamide
CID 3702583
N-(2-bromo-4-fluorophenyl)-2,5-dichlorobenzenesulfonamide
CID 3701608
N-(4-amino-2-chlorophenyl)-2-chloro-5-fluorobenzenesulfonamide
CID 105399440
N-(5-amino-2-fluorophenyl)-2-chloro-5-fluorobenzenesulfonamide
CID 105399424
5-amino-2-chloro-N-(2,5-difluorophenyl)benzenesulfonamide
CID 29275941
2,5-dichloro-N-(2-fluoro-4-iodophenyl)benzenesulfonamide
CID 3776301
N-(2-bromo-4-chlorophenyl)-2,5-dichlorobenzenesulfonamide
CID 81273911
3,4-dichloro-N-(2-chloro-4-fluorophenyl)benzenesulfonamide
CID 26969900
4-chloro-N-(2,4-difluorophenyl)-2-fluorobenzenesulfonamide
CID 4968602
N-(5-chloro-2-fluorophenyl)-2,5-difluorobenzenesulfonamide
CID 9238961
N-(4-amino-2-bromophenyl)-2-chloro-5-fluorobenzenesulfonamide
CID 105399526
N-(2-chlorophenyl)-2,5-difluorobenzenesulfonamide
CID 9234601

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N-(2-chloro-4-fluorophenyl)benzenesulfonamide?
The IUPAC name of 2,5-dichloro-N-(2-chloro-4-fluorophenyl)benzenesulfonamide (CID 26969901) is 2,5-dichloro-N-(2-chloro-4-fluorophenyl)benzenesulfonamide.
What is the SMILES notation for 2,5-dichloro-N-(2-chloro-4-fluorophenyl)benzenesulfonamide?
The canonical SMILES for 2,5-dichloro-N-(2-chloro-4-fluorophenyl)benzenesulfonamide is O=S(=O)(Nc1ccc(F)cc1Cl)c1cc(Cl)ccc1Cl.
What is the InChIKey of 2,5-dichloro-N-(2-chloro-4-fluorophenyl)benzenesulfonamide?
The InChIKey is IGNVJECDSGQWMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7Cl3FNO2S/c13-7-1-3-9(14)12(5-7)20(18,19)17-11-4-2-8(16)6-10(11)15/h1-6,17H.
What are the key properties of 2,5-dichloro-N-(2-chloro-4-fluorophenyl)benzenesulfonamide?
2,5-dichloro-N-(2-chloro-4-fluorophenyl)benzenesulfonamide has a molecular weight of 354.62 g/mol, XLogP of 4.59, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-N-(2-chloro-4-fluorophenyl)benzenesulfonamide is sourced from PubChem (CID 26969901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).