2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2,4-difluorophenyl)acetamide

C15H12Cl2F2N2O3S — CID 1326607

IUPAC2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2,4-difluorophenyl)acetamide
SMILESCS(=O)(=O)N(CC(=O)Nc1ccc(F)cc1F)c1cc(Cl)ccc1Cl
InChIInChI=1S/C15H12Cl2F2N2O3S/c1-25(23,24)21(14-6-9(16)2-4-11(14)17)8-15(22)20-13-5-3-10(18)7-12(13)19/h2-7H,8H2,1H3,(H,20,22)
InChIKeyGIGVAJYEJKRYGN-UHFFFAOYSA-N
MW409.24 g/mol
LogP3.68
Rot. Bonds5

About 2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2,4-difluorophenyl)acetamide

2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2,4-difluorophenyl)acetamide (PubChem CID 1326607) has the molecular formula C15H12Cl2F2N2O3S and a molecular weight of 409.24 g/mol. Its IUPAC name is 2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2,4-difluorophenyl)acetamide.

Molecular Properties

Compound Name2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2,4-difluorophenyl)acetamide
PubChem CID1326607
Molecular FormulaC15H12Cl2F2N2O3S
Molecular Weight409.24 g/mol
Exact Mass407.99
IUPAC Name2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2,4-difluorophenyl)acetamide
SMILESCS(=O)(=O)N(CC(=O)Nc1ccc(F)cc1F)c1cc(Cl)ccc1Cl
InChIInChI=1S/C15H12Cl2F2N2O3S/c1-25(23,24)21(14-6-9(16)2-4-11(14)17)8-15(22)20-13-5-3-10(18)7-12(13)19/h2-7H,8H2,1H3,(H,20,22)
InChIKeyGIGVAJYEJKRYGN-UHFFFAOYSA-N
XLogP3.68
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.24
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2,4-difluorophenyl)acetamide?
The IUPAC name of 2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2,4-difluorophenyl)acetamide (CID 1326607) is 2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2,4-difluorophenyl)acetamide.
What is the SMILES notation for 2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2,4-difluorophenyl)acetamide?
The canonical SMILES for 2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2,4-difluorophenyl)acetamide is CS(=O)(=O)N(CC(=O)Nc1ccc(F)cc1F)c1cc(Cl)ccc1Cl.
What is the InChIKey of 2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2,4-difluorophenyl)acetamide?
The InChIKey is GIGVAJYEJKRYGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2F2N2O3S/c1-25(23,24)21(14-6-9(16)2-4-11(14)17)8-15(22)20-13-5-3-10(18)7-12(13)19/h2-7H,8H2,1H3,(H,20,22).
What are the key properties of 2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2,4-difluorophenyl)acetamide?
2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2,4-difluorophenyl)acetamide has a molecular weight of 409.24 g/mol, XLogP of 3.68, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2,4-difluorophenyl)acetamide is sourced from PubChem (CID 1326607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).