2-chloro-5-[ethyl(phenyl)sulfamoyl]-N-(furan-2-ylmethyl)benzamide

C20H19ClN2O4S — CID 2499798

IUPAC2-chloro-5-[ethyl(phenyl)sulfamoyl]-N-(furan-2-ylmethyl)benzamide
SMILESCCN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccco2)c1
InChIInChI=1S/C20H19ClN2O4S/c1-2-23(15-7-4-3-5-8-15)28(25,26)17-10-11-19(21)18(13-17)20(24)22-14-16-9-6-12-27-16/h3-13H,2,14H2,1H3,(H,22,24)
InChIKeyJOMHVSUHXOLDMN-UHFFFAOYSA-N
MW418.90 g/mol
LogP4.08
Rot. Bonds7

About 2-chloro-5-[ethyl(phenyl)sulfamoyl]-N-(furan-2-ylmethyl)benzamide

2-chloro-5-[ethyl(phenyl)sulfamoyl]-N-(furan-2-ylmethyl)benzamide (PubChem CID 2499798) has the molecular formula C20H19ClN2O4S and a molecular weight of 418.90 g/mol. Its IUPAC name is 2-chloro-5-[ethyl(phenyl)sulfamoyl]-N-(furan-2-ylmethyl)benzamide.

Molecular Properties

Compound Name2-chloro-5-[ethyl(phenyl)sulfamoyl]-N-(furan-2-ylmethyl)benzamide
PubChem CID2499798
Molecular FormulaC20H19ClN2O4S
Molecular Weight418.90 g/mol
Exact Mass418.08
IUPAC Name2-chloro-5-[ethyl(phenyl)sulfamoyl]-N-(furan-2-ylmethyl)benzamide
SMILESCCN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccco2)c1
InChIInChI=1S/C20H19ClN2O4S/c1-2-23(15-7-4-3-5-8-15)28(25,26)17-10-11-19(21)18(13-17)20(24)22-14-16-9-6-12-27-16/h3-13H,2,14H2,1H3,(H,22,24)
InChIKeyJOMHVSUHXOLDMN-UHFFFAOYSA-N
XLogP4.08
TPSA79.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.90
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-[ethyl(phenyl)sulfamoyl]-N-(furan-2-ylmethyl)benzamide?
The IUPAC name of 2-chloro-5-[ethyl(phenyl)sulfamoyl]-N-(furan-2-ylmethyl)benzamide (CID 2499798) is 2-chloro-5-[ethyl(phenyl)sulfamoyl]-N-(furan-2-ylmethyl)benzamide.
What is the SMILES notation for 2-chloro-5-[ethyl(phenyl)sulfamoyl]-N-(furan-2-ylmethyl)benzamide?
The canonical SMILES for 2-chloro-5-[ethyl(phenyl)sulfamoyl]-N-(furan-2-ylmethyl)benzamide is CCN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccco2)c1.
What is the InChIKey of 2-chloro-5-[ethyl(phenyl)sulfamoyl]-N-(furan-2-ylmethyl)benzamide?
The InChIKey is JOMHVSUHXOLDMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19ClN2O4S/c1-2-23(15-7-4-3-5-8-15)28(25,26)17-10-11-19(21)18(13-17)20(24)22-14-16-9-6-12-27-16/h3-13H,2,14H2,1H3,(H,22,24).
What are the key properties of 2-chloro-5-[ethyl(phenyl)sulfamoyl]-N-(furan-2-ylmethyl)benzamide?
2-chloro-5-[ethyl(phenyl)sulfamoyl]-N-(furan-2-ylmethyl)benzamide has a molecular weight of 418.90 g/mol, XLogP of 4.08, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-[ethyl(phenyl)sulfamoyl]-N-(furan-2-ylmethyl)benzamide is sourced from PubChem (CID 2499798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).