2-chloro-N-(furan-2-ylmethyl)-5-[(2-methoxyphenyl)-methylsulfamoyl]benzamide

C20H19ClN2O5S — CID 2565072

IUPAC2-chloro-N-(furan-2-ylmethyl)-5-[(2-methoxyphenyl)-methylsulfamoyl]benzamide
SMILESCOc1ccccc1N(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccco2)c1
InChIInChI=1S/C20H19ClN2O5S/c1-23(18-7-3-4-8-19(18)27-2)29(25,26)15-9-10-17(21)16(12-15)20(24)22-13-14-6-5-11-28-14/h3-12H,13H2,1-2H3,(H,22,24)
InChIKeyOOYGBTGZDCPTKO-UHFFFAOYSA-N
MW434.90 g/mol
LogP3.70
Rot. Bonds7

About 2-chloro-N-(furan-2-ylmethyl)-5-[(2-methoxyphenyl)-methylsulfamoyl]benzamide

2-chloro-N-(furan-2-ylmethyl)-5-[(2-methoxyphenyl)-methylsulfamoyl]benzamide (PubChem CID 2565072) has the molecular formula C20H19ClN2O5S and a molecular weight of 434.90 g/mol. Its IUPAC name is 2-chloro-N-(furan-2-ylmethyl)-5-[(2-methoxyphenyl)-methylsulfamoyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-(furan-2-ylmethyl)-5-[(2-methoxyphenyl)-methylsulfamoyl]benzamide
PubChem CID2565072
Molecular FormulaC20H19ClN2O5S
Molecular Weight434.90 g/mol
Exact Mass434.07
IUPAC Name2-chloro-N-(furan-2-ylmethyl)-5-[(2-methoxyphenyl)-methylsulfamoyl]benzamide
SMILESCOc1ccccc1N(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccco2)c1
InChIInChI=1S/C20H19ClN2O5S/c1-23(18-7-3-4-8-19(18)27-2)29(25,26)15-9-10-17(21)16(12-15)20(24)22-13-14-6-5-11-28-14/h3-12H,13H2,1-2H3,(H,22,24)
InChIKeyOOYGBTGZDCPTKO-UHFFFAOYSA-N
XLogP3.70
TPSA88.85 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.90
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-acetamidoethyl)-2-chloro-5-[(2-methoxyphenyl)-methylsulfamoyl]benzamide
CID 26655839
2-chloro-5-(dimethylsulfamoyl)-N-[(2-methoxyphenyl)methyl]benzamide
CID 2713234
2-chloro-N-(2-fluorophenyl)-5-[(2-methoxyphenyl)-methylsulfamoyl]benzamide
CID 26115061
N-(furan-2-ylmethyl)-5-[(2-methoxyphenyl)-methylsulfamoyl]-2-methyl-N-(2,2,2-trifluoroethyl)benzamide
CID 55368442
N-[(2,3-dimethoxyphenyl)methyl]-5-[(2-methoxyphenyl)-methylsulfamoyl]-2-methylbenzamide
CID 46586819
N-[2-(2-methoxyphenoxy)ethyl]-5-[(2-methoxyphenyl)-methylsulfamoyl]-2-methylbenzamide
CID 38452304
2-chloro-5-(dimethylsulfamoyl)-N-[2-(furan-2-yl)ethyl]benzamide
CID 8916939
2-chloro-N-(furan-3-ylmethyl)-5-[(2-methoxyphenyl)-prop-2-enylsulfamoyl]benzamide
CID 55838273
N-(furan-2-ylmethyl)-2,4,5-trimethoxybenzamide
CID 1089288
[2-(butylamino)-2-oxoethyl] 2-chloro-5-[(2-methoxyphenyl)-methylsulfamoyl]benzoate
CID 2614350
2-chloro-5-[(4-fluorophenyl)-methylsulfamoyl]-N-[3-(furan-2-ylmethoxy)propyl]benzamide
CID 55471264
2,5-dichloro-N-(furan-2-ylmethyl)benzamide
CID 690467

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(furan-2-ylmethyl)-5-[(2-methoxyphenyl)-methylsulfamoyl]benzamide?
The IUPAC name of 2-chloro-N-(furan-2-ylmethyl)-5-[(2-methoxyphenyl)-methylsulfamoyl]benzamide (CID 2565072) is 2-chloro-N-(furan-2-ylmethyl)-5-[(2-methoxyphenyl)-methylsulfamoyl]benzamide.
What is the SMILES notation for 2-chloro-N-(furan-2-ylmethyl)-5-[(2-methoxyphenyl)-methylsulfamoyl]benzamide?
The canonical SMILES for 2-chloro-N-(furan-2-ylmethyl)-5-[(2-methoxyphenyl)-methylsulfamoyl]benzamide is COc1ccccc1N(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccco2)c1.
What is the InChIKey of 2-chloro-N-(furan-2-ylmethyl)-5-[(2-methoxyphenyl)-methylsulfamoyl]benzamide?
The InChIKey is OOYGBTGZDCPTKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19ClN2O5S/c1-23(18-7-3-4-8-19(18)27-2)29(25,26)15-9-10-17(21)16(12-15)20(24)22-13-14-6-5-11-28-14/h3-12H,13H2,1-2H3,(H,22,24).
What are the key properties of 2-chloro-N-(furan-2-ylmethyl)-5-[(2-methoxyphenyl)-methylsulfamoyl]benzamide?
2-chloro-N-(furan-2-ylmethyl)-5-[(2-methoxyphenyl)-methylsulfamoyl]benzamide has a molecular weight of 434.90 g/mol, XLogP of 3.70, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(furan-2-ylmethyl)-5-[(2-methoxyphenyl)-methylsulfamoyl]benzamide is sourced from PubChem (CID 2565072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).