N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-phenoxyacetamide

C20H17ClN2O4S — CID 26593129

IUPACN-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-phenoxyacetamide
SMILESO=C(COc1ccccc1)Nc1cccc(S(=O)(=O)Nc2ccccc2Cl)c1
InChIInChI=1S/C20H17ClN2O4S/c21-18-11-4-5-12-19(18)23-28(25,26)17-10-6-7-15(13-17)22-20(24)14-27-16-8-2-1-3-9-16/h1-13,23H,14H2,(H,22,24)
InChIKeyASOYECMWZMXHLT-UHFFFAOYSA-N
MW416.89 g/mol
LogP4.16
Rot. Bonds7

About N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-phenoxyacetamide

N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-phenoxyacetamide (PubChem CID 26593129) has the molecular formula C20H17ClN2O4S and a molecular weight of 416.89 g/mol. Its IUPAC name is N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-phenoxyacetamide.

Molecular Properties

Compound NameN-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-phenoxyacetamide
PubChem CID26593129
Molecular FormulaC20H17ClN2O4S
Molecular Weight416.89 g/mol
Exact Mass416.06
IUPAC NameN-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-phenoxyacetamide
SMILESO=C(COc1ccccc1)Nc1cccc(S(=O)(=O)Nc2ccccc2Cl)c1
InChIInChI=1S/C20H17ClN2O4S/c21-18-11-4-5-12-19(18)23-28(25,26)17-10-6-7-15(13-17)22-20(24)14-27-16-8-2-1-3-9-16/h1-13,23H,14H2,(H,22,24)
InChIKeyASOYECMWZMXHLT-UHFFFAOYSA-N
XLogP4.16
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.89
LogP ≤ 54.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-phenoxyacetamide?
The IUPAC name of N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-phenoxyacetamide (CID 26593129) is N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-phenoxyacetamide.
What is the SMILES notation for N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-phenoxyacetamide?
The canonical SMILES for N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-phenoxyacetamide is O=C(COc1ccccc1)Nc1cccc(S(=O)(=O)Nc2ccccc2Cl)c1.
What is the InChIKey of N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-phenoxyacetamide?
The InChIKey is ASOYECMWZMXHLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClN2O4S/c21-18-11-4-5-12-19(18)23-28(25,26)17-10-6-7-15(13-17)22-20(24)14-27-16-8-2-1-3-9-16/h1-13,23H,14H2,(H,22,24).
What are the key properties of N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-phenoxyacetamide?
N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-phenoxyacetamide has a molecular weight of 416.89 g/mol, XLogP of 4.16, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-phenoxyacetamide is sourced from PubChem (CID 26593129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).