2,4-dichloro-5-(diethylsulfamoyl)-N-(2-methylbutan-2-yl)benzamide

C16H24Cl2N2O3S — CID 4776215

IUPAC2,4-dichloro-5-(diethylsulfamoyl)-N-(2-methylbutan-2-yl)benzamide
SMILESCCN(CC)S(=O)(=O)c1cc(C(=O)NC(C)(C)CC)c(Cl)cc1Cl
InChIInChI=1S/C16H24Cl2N2O3S/c1-6-16(4,5)19-15(21)11-9-14(13(18)10-12(11)17)24(22,23)20(7-2)8-3/h9-10H,6-8H2,1-5H3,(H,19,21)
InChIKeyNSSUAIKIQQEKOM-UHFFFAOYSA-N
MW395.35 g/mol
LogP3.94
Rot. Bonds7

About 2,4-dichloro-5-(diethylsulfamoyl)-N-(2-methylbutan-2-yl)benzamide

2,4-dichloro-5-(diethylsulfamoyl)-N-(2-methylbutan-2-yl)benzamide (PubChem CID 4776215) has the molecular formula C16H24Cl2N2O3S and a molecular weight of 395.35 g/mol. Its IUPAC name is 2,4-dichloro-5-(diethylsulfamoyl)-N-(2-methylbutan-2-yl)benzamide.

Molecular Properties

Compound Name2,4-dichloro-5-(diethylsulfamoyl)-N-(2-methylbutan-2-yl)benzamide
PubChem CID4776215
Molecular FormulaC16H24Cl2N2O3S
Molecular Weight395.35 g/mol
Exact Mass394.09
IUPAC Name2,4-dichloro-5-(diethylsulfamoyl)-N-(2-methylbutan-2-yl)benzamide
SMILESCCN(CC)S(=O)(=O)c1cc(C(=O)NC(C)(C)CC)c(Cl)cc1Cl
InChIInChI=1S/C16H24Cl2N2O3S/c1-6-16(4,5)19-15(21)11-9-14(13(18)10-12(11)17)24(22,23)20(7-2)8-3/h9-10H,6-8H2,1-5H3,(H,19,21)
InChIKeyNSSUAIKIQQEKOM-UHFFFAOYSA-N
XLogP3.94
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.35
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-5-(diethylsulfamoyl)-N-(2-methylbutan-2-yl)benzamide?
The IUPAC name of 2,4-dichloro-5-(diethylsulfamoyl)-N-(2-methylbutan-2-yl)benzamide (CID 4776215) is 2,4-dichloro-5-(diethylsulfamoyl)-N-(2-methylbutan-2-yl)benzamide.
What is the SMILES notation for 2,4-dichloro-5-(diethylsulfamoyl)-N-(2-methylbutan-2-yl)benzamide?
The canonical SMILES for 2,4-dichloro-5-(diethylsulfamoyl)-N-(2-methylbutan-2-yl)benzamide is CCN(CC)S(=O)(=O)c1cc(C(=O)NC(C)(C)CC)c(Cl)cc1Cl.
What is the InChIKey of 2,4-dichloro-5-(diethylsulfamoyl)-N-(2-methylbutan-2-yl)benzamide?
The InChIKey is NSSUAIKIQQEKOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24Cl2N2O3S/c1-6-16(4,5)19-15(21)11-9-14(13(18)10-12(11)17)24(22,23)20(7-2)8-3/h9-10H,6-8H2,1-5H3,(H,19,21).
What are the key properties of 2,4-dichloro-5-(diethylsulfamoyl)-N-(2-methylbutan-2-yl)benzamide?
2,4-dichloro-5-(diethylsulfamoyl)-N-(2-methylbutan-2-yl)benzamide has a molecular weight of 395.35 g/mol, XLogP of 3.94, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-5-(diethylsulfamoyl)-N-(2-methylbutan-2-yl)benzamide is sourced from PubChem (CID 4776215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).