N-(3,5-dichlorophenyl)-2-methylsulfonylbenzamide

C14H11Cl2NO3S — CID 7565546

IUPACN-(3,5-dichlorophenyl)-2-methylsulfonylbenzamide
SMILESCS(=O)(=O)c1ccccc1C(=O)Nc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C14H11Cl2NO3S/c1-21(19,20)13-5-3-2-4-12(13)14(18)17-11-7-9(15)6-10(16)8-11/h2-8H,1H3,(H,17,18)
InChIKeySCLFUBJZUJBUMF-UHFFFAOYSA-N
MW344.22 g/mol
LogP3.65
Rot. Bonds3

About N-(3,5-dichlorophenyl)-2-methylsulfonylbenzamide

N-(3,5-dichlorophenyl)-2-methylsulfonylbenzamide (PubChem CID 7565546) has the molecular formula C14H11Cl2NO3S and a molecular weight of 344.22 g/mol. Its IUPAC name is N-(3,5-dichlorophenyl)-2-methylsulfonylbenzamide.

Molecular Properties

Compound NameN-(3,5-dichlorophenyl)-2-methylsulfonylbenzamide
PubChem CID7565546
Molecular FormulaC14H11Cl2NO3S
Molecular Weight344.22 g/mol
Exact Mass342.98
IUPAC NameN-(3,5-dichlorophenyl)-2-methylsulfonylbenzamide
SMILESCS(=O)(=O)c1ccccc1C(=O)Nc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C14H11Cl2NO3S/c1-21(19,20)13-5-3-2-4-12(13)14(18)17-11-7-9(15)6-10(16)8-11/h2-8H,1H3,(H,17,18)
InChIKeySCLFUBJZUJBUMF-UHFFFAOYSA-N
XLogP3.65
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.22
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetamidophenyl)-2-methylsulfonylbenzamide
CID 8701377
N-(5-chloro-2-fluorophenyl)-2-methylsulfonylbenzamide
CID 18082595
N-(3-acetylphenyl)-2-methylsulfonylbenzamide
CID 2522636
N-hydroxy-2-methylsulfonylbenzamide
CID 20613410
N-(1-tert-butylpyrazol-4-yl)-2-methylsulfonylbenzamide
CID 86860481
N-(3,5-dichlorophenyl)-2-methylsulfonylbenzenesulfonamide
CID 55532986
2-anilino-N-(3,5-dichlorophenyl)benzamide
CID 54784944
2-(aminomethyl)-N-(3,5-dichlorophenyl)benzamide
CID 82546015
N-(3,5-dichlorophenyl)-2-[(2,5-dimethylphenyl)sulfonylamino]benzamide
CID 2333532
N-(3,5-dichlorophenyl)-2,3-difluorobenzamide
CID 62650988
ethyl 4-[(2-methylsulfonylbenzoyl)amino]benzoate
CID 7267042
N-[4-(cyclopropylcarbamoyl)phenyl]-2-methylsulfonylbenzamide
CID 18132726

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichlorophenyl)-2-methylsulfonylbenzamide?
The IUPAC name of N-(3,5-dichlorophenyl)-2-methylsulfonylbenzamide (CID 7565546) is N-(3,5-dichlorophenyl)-2-methylsulfonylbenzamide.
What is the SMILES notation for N-(3,5-dichlorophenyl)-2-methylsulfonylbenzamide?
The canonical SMILES for N-(3,5-dichlorophenyl)-2-methylsulfonylbenzamide is CS(=O)(=O)c1ccccc1C(=O)Nc1cc(Cl)cc(Cl)c1.
What is the InChIKey of N-(3,5-dichlorophenyl)-2-methylsulfonylbenzamide?
The InChIKey is SCLFUBJZUJBUMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2NO3S/c1-21(19,20)13-5-3-2-4-12(13)14(18)17-11-7-9(15)6-10(16)8-11/h2-8H,1H3,(H,17,18).
What are the key properties of N-(3,5-dichlorophenyl)-2-methylsulfonylbenzamide?
N-(3,5-dichlorophenyl)-2-methylsulfonylbenzamide has a molecular weight of 344.22 g/mol, XLogP of 3.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichlorophenyl)-2-methylsulfonylbenzamide is sourced from PubChem (CID 7565546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).