2,4-dichloro-N-[2-(methanesulfonamido)phenyl]benzamide

C14H12Cl2N2O3S — CID 35368130

IUPAC2,4-dichloro-N-[2-(methanesulfonamido)phenyl]benzamide
SMILESCS(=O)(=O)Nc1ccccc1NC(=O)c1ccc(Cl)cc1Cl
InChIInChI=1S/C14H12Cl2N2O3S/c1-22(20,21)18-13-5-3-2-4-12(13)17-14(19)10-7-6-9(15)8-11(10)16/h2-8,18H,1H3,(H,17,19)
InChIKeyQFEMCGBPAWTUIO-UHFFFAOYSA-N
MW359.23 g/mol
LogP3.62
Rot. Bonds4

About 2,4-dichloro-N-[2-(methanesulfonamido)phenyl]benzamide

2,4-dichloro-N-[2-(methanesulfonamido)phenyl]benzamide (PubChem CID 35368130) has the molecular formula C14H12Cl2N2O3S and a molecular weight of 359.23 g/mol. Its IUPAC name is 2,4-dichloro-N-[2-(methanesulfonamido)phenyl]benzamide.

Molecular Properties

Compound Name2,4-dichloro-N-[2-(methanesulfonamido)phenyl]benzamide
PubChem CID35368130
Molecular FormulaC14H12Cl2N2O3S
Molecular Weight359.23 g/mol
Exact Mass357.99
IUPAC Name2,4-dichloro-N-[2-(methanesulfonamido)phenyl]benzamide
SMILESCS(=O)(=O)Nc1ccccc1NC(=O)c1ccc(Cl)cc1Cl
InChIInChI=1S/C14H12Cl2N2O3S/c1-22(20,21)18-13-5-3-2-4-12(13)17-14(19)10-7-6-9(15)8-11(10)16/h2-8,18H,1H3,(H,17,19)
InChIKeyQFEMCGBPAWTUIO-UHFFFAOYSA-N
XLogP3.62
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.23
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-N-[2-(methanesulfonamido)phenyl]benzamide?
The IUPAC name of 2,4-dichloro-N-[2-(methanesulfonamido)phenyl]benzamide (CID 35368130) is 2,4-dichloro-N-[2-(methanesulfonamido)phenyl]benzamide.
What is the SMILES notation for 2,4-dichloro-N-[2-(methanesulfonamido)phenyl]benzamide?
The canonical SMILES for 2,4-dichloro-N-[2-(methanesulfonamido)phenyl]benzamide is CS(=O)(=O)Nc1ccccc1NC(=O)c1ccc(Cl)cc1Cl.
What is the InChIKey of 2,4-dichloro-N-[2-(methanesulfonamido)phenyl]benzamide?
The InChIKey is QFEMCGBPAWTUIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2O3S/c1-22(20,21)18-13-5-3-2-4-12(13)17-14(19)10-7-6-9(15)8-11(10)16/h2-8,18H,1H3,(H,17,19).
What are the key properties of 2,4-dichloro-N-[2-(methanesulfonamido)phenyl]benzamide?
2,4-dichloro-N-[2-(methanesulfonamido)phenyl]benzamide has a molecular weight of 359.23 g/mol, XLogP of 3.62, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-N-[2-(methanesulfonamido)phenyl]benzamide is sourced from PubChem (CID 35368130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).