4-(diethylsulfamoyl)-N-[(S)-furan-2-yl(phenyl)methyl]benzamide

C22H24N2O4S — CID 8928237

IUPAC4-(diethylsulfamoyl)-N-[(S)-furan-2-yl(phenyl)methyl]benzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(C(=O)N[C@@H](c2ccccc2)c2ccco2)cc1
InChIInChI=1S/C22H24N2O4S/c1-3-24(4-2)29(26,27)19-14-12-18(13-15-19)22(25)23-21(20-11-8-16-28-20)17-9-6-5-7-10-17/h5-16,21H,3-4H2,1-2H3,(H,23,25)/t21-/m0/s1
InChIKeyNBXWNSYBBQUWDM-NRFANRHFSA-N
MW412.51 g/mol
LogP3.83
Rot. Bonds8

About 4-(diethylsulfamoyl)-N-[(S)-furan-2-yl(phenyl)methyl]benzamide

4-(diethylsulfamoyl)-N-[(S)-furan-2-yl(phenyl)methyl]benzamide (PubChem CID 8928237) has the molecular formula C22H24N2O4S and a molecular weight of 412.51 g/mol. Its IUPAC name is 4-(diethylsulfamoyl)-N-[(S)-furan-2-yl(phenyl)methyl]benzamide.

Molecular Properties

Compound Name4-(diethylsulfamoyl)-N-[(S)-furan-2-yl(phenyl)methyl]benzamide
PubChem CID8928237
Molecular FormulaC22H24N2O4S
Molecular Weight412.51 g/mol
Exact Mass412.15
IUPAC Name4-(diethylsulfamoyl)-N-[(S)-furan-2-yl(phenyl)methyl]benzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(C(=O)N[C@@H](c2ccccc2)c2ccco2)cc1
InChIInChI=1S/C22H24N2O4S/c1-3-24(4-2)29(26,27)19-14-12-18(13-15-19)22(25)23-21(20-11-8-16-28-20)17-9-6-5-7-10-17/h5-16,21H,3-4H2,1-2H3,(H,23,25)/t21-/m0/s1
InChIKeyNBXWNSYBBQUWDM-NRFANRHFSA-N
XLogP3.83
TPSA79.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.51
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[furan-2-yl(phenyl)methyl]-4-[methyl-(4-methylphenyl)sulfonylamino]benzamide
CID 55405944
4-[[ethyl(propan-2-yl)amino]methyl]-N-[(S)-furan-2-yl(phenyl)methyl]benzamide
CID 52516146
(2R)-2-[[4-(diethylsulfamoyl)benzoyl]amino]-2-phenylacetic acid
CID 119367792
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[furan-2-yl(phenyl)methyl]acetamide
CID 55384576
4-(dimethylamino)-N-[furan-2-yl(phenyl)methyl]benzamide
CID 134029302
[(1R)-2-[[4-(diethylsulfamoyl)benzoyl]amino]-1-(furan-2-yl)ethyl]-dimethylazanium
CID 2533073
4-(acetamidomethyl)-N-[furan-2-yl(phenyl)methyl]benzamide
CID 134029454
N-[(S)-furan-2-yl(phenyl)methyl]-4-(trifluoromethyl)benzamide
CID 8928135
4-(diethylsulfamoyl)-N-(furan-2-ylmethyl)benzamide
CID 2596785
3,4,5-triethoxy-N-[(S)-furan-2-yl(phenyl)methyl]benzamide
CID 8928137
4-(diethylsulfamoyl)-N-(2-phenylbutyl)benzamide
CID 43016057
N-[(R)-furan-2-yl(phenyl)methyl]-3,5-dimethylbenzamide
CID 8928204

Frequently Asked Questions

What is the IUPAC name of 4-(diethylsulfamoyl)-N-[(S)-furan-2-yl(phenyl)methyl]benzamide?
The IUPAC name of 4-(diethylsulfamoyl)-N-[(S)-furan-2-yl(phenyl)methyl]benzamide (CID 8928237) is 4-(diethylsulfamoyl)-N-[(S)-furan-2-yl(phenyl)methyl]benzamide.
What is the SMILES notation for 4-(diethylsulfamoyl)-N-[(S)-furan-2-yl(phenyl)methyl]benzamide?
The canonical SMILES for 4-(diethylsulfamoyl)-N-[(S)-furan-2-yl(phenyl)methyl]benzamide is CCN(CC)S(=O)(=O)c1ccc(C(=O)N[C@@H](c2ccccc2)c2ccco2)cc1.
What is the InChIKey of 4-(diethylsulfamoyl)-N-[(S)-furan-2-yl(phenyl)methyl]benzamide?
The InChIKey is NBXWNSYBBQUWDM-NRFANRHFSA-N. The full InChI is InChI=1S/C22H24N2O4S/c1-3-24(4-2)29(26,27)19-14-12-18(13-15-19)22(25)23-21(20-11-8-16-28-20)17-9-6-5-7-10-17/h5-16,21H,3-4H2,1-2H3,(H,23,25)/t21-/m0/s1.
What are the key properties of 4-(diethylsulfamoyl)-N-[(S)-furan-2-yl(phenyl)methyl]benzamide?
4-(diethylsulfamoyl)-N-[(S)-furan-2-yl(phenyl)methyl]benzamide has a molecular weight of 412.51 g/mol, XLogP of 3.83, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(diethylsulfamoyl)-N-[(S)-furan-2-yl(phenyl)methyl]benzamide is sourced from PubChem (CID 8928237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).