1-(4-chlorophenyl)-N-(2,5-dichlorophenyl)methanesulfonamide

C13H10Cl3NO2S — CID 18891286

IUPAC1-(4-chlorophenyl)-N-(2,5-dichlorophenyl)methanesulfonamide
SMILESO=S(=O)(Cc1ccc(Cl)cc1)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C13H10Cl3NO2S/c14-10-3-1-9(2-4-10)8-20(18,19)17-13-7-11(15)5-6-12(13)16/h1-7,17H,8H2
InChIKeyGZIAOCDUYWQJCR-UHFFFAOYSA-N
MW350.65 g/mol
LogP4.59
Rot. Bonds4

About 1-(4-chlorophenyl)-N-(2,5-dichlorophenyl)methanesulfonamide

1-(4-chlorophenyl)-N-(2,5-dichlorophenyl)methanesulfonamide (PubChem CID 18891286) has the molecular formula C13H10Cl3NO2S and a molecular weight of 350.65 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-N-(2,5-dichlorophenyl)methanesulfonamide.

Molecular Properties

Compound Name1-(4-chlorophenyl)-N-(2,5-dichlorophenyl)methanesulfonamide
PubChem CID18891286
Molecular FormulaC13H10Cl3NO2S
Molecular Weight350.65 g/mol
Exact Mass348.95
IUPAC Name1-(4-chlorophenyl)-N-(2,5-dichlorophenyl)methanesulfonamide
SMILESO=S(=O)(Cc1ccc(Cl)cc1)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C13H10Cl3NO2S/c14-10-3-1-9(2-4-10)8-20(18,19)17-13-7-11(15)5-6-12(13)16/h1-7,17H,8H2
InChIKeyGZIAOCDUYWQJCR-UHFFFAOYSA-N
XLogP4.59
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.65
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-chlorophenyl)-N-[2-chloro-5-(trifluoromethyl)phenyl]methanesulfonamide
CID 18891357
N-(2-chloro-5-nitrophenyl)-1-(4-chlorophenyl)methanesulfonamide
CID 18891447
1-[3-(aminomethyl)phenyl]-N-(2,5-dichlorophenyl)methanesulfonamide
CID 106037003
1-[4-(aminomethyl)phenyl]-N-(2,4-dichlorophenyl)methanesulfonamide
CID 106057447
N-(5-chloro-2-methylphenyl)-1-phenylmethanesulfonamide
CID 788792
1-(4-chlorophenyl)-N-(2-methylsulfanylphenyl)methanesulfonamide
CID 18891408
1-(4-chlorophenyl)-N-(2,3-dimethylphenyl)methanesulfonamide
CID 18891284
2-[(4-chlorophenyl)methylsulfonylamino]benzamide
CID 2227897
N-(2-chloro-5-pyrrolidin-1-ylphenyl)-1-phenylmethanesulfonamide
CID 110361957
N-(2,5-dichlorophenyl)propane-2-sulfonamide
CID 62999639
1-(4-chlorophenyl)-N-(3-methylphenyl)methanesulfonamide
CID 18891258
N-(2,5-dichlorophenyl)-4-(propan-2-ylamino)butane-1-sulfonamide
CID 106037094

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-N-(2,5-dichlorophenyl)methanesulfonamide?
The IUPAC name of 1-(4-chlorophenyl)-N-(2,5-dichlorophenyl)methanesulfonamide (CID 18891286) is 1-(4-chlorophenyl)-N-(2,5-dichlorophenyl)methanesulfonamide.
What is the SMILES notation for 1-(4-chlorophenyl)-N-(2,5-dichlorophenyl)methanesulfonamide?
The canonical SMILES for 1-(4-chlorophenyl)-N-(2,5-dichlorophenyl)methanesulfonamide is O=S(=O)(Cc1ccc(Cl)cc1)Nc1cc(Cl)ccc1Cl.
What is the InChIKey of 1-(4-chlorophenyl)-N-(2,5-dichlorophenyl)methanesulfonamide?
The InChIKey is GZIAOCDUYWQJCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10Cl3NO2S/c14-10-3-1-9(2-4-10)8-20(18,19)17-13-7-11(15)5-6-12(13)16/h1-7,17H,8H2.
What are the key properties of 1-(4-chlorophenyl)-N-(2,5-dichlorophenyl)methanesulfonamide?
1-(4-chlorophenyl)-N-(2,5-dichlorophenyl)methanesulfonamide has a molecular weight of 350.65 g/mol, XLogP of 4.59, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-N-(2,5-dichlorophenyl)methanesulfonamide is sourced from PubChem (CID 18891286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).