4-(dimethylsulfamoyl)-N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]benzamide

C18H18N4O4S — CID 121198772

IUPAC4-(dimethylsulfamoyl)-N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]benzamide
SMILESCN(C)S(=O)(=O)c1ccc(C(=O)NCc2nccnc2-c2ccco2)cc1
InChIInChI=1S/C18H18N4O4S/c1-22(2)27(24,25)14-7-5-13(6-8-14)18(23)21-12-15-17(20-10-9-19-15)16-4-3-11-26-16/h3-11H,12H2,1-2H3,(H,21,23)
InChIKeyGUWDECLXQFEBSL-UHFFFAOYSA-N
MW386.43 g/mol
LogP1.92
Rot. Bonds6

About 4-(dimethylsulfamoyl)-N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]benzamide

4-(dimethylsulfamoyl)-N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]benzamide (PubChem CID 121198772) has the molecular formula C18H18N4O4S and a molecular weight of 386.43 g/mol. Its IUPAC name is 4-(dimethylsulfamoyl)-N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]benzamide.

Molecular Properties

Compound Name4-(dimethylsulfamoyl)-N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]benzamide
PubChem CID121198772
Molecular FormulaC18H18N4O4S
Molecular Weight386.43 g/mol
Exact Mass386.10
IUPAC Name4-(dimethylsulfamoyl)-N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]benzamide
SMILESCN(C)S(=O)(=O)c1ccc(C(=O)NCc2nccnc2-c2ccco2)cc1
InChIInChI=1S/C18H18N4O4S/c1-22(2)27(24,25)14-7-5-13(6-8-14)18(23)21-12-15-17(20-10-9-19-15)16-4-3-11-26-16/h3-11H,12H2,1-2H3,(H,21,23)
InChIKeyGUWDECLXQFEBSL-UHFFFAOYSA-N
XLogP1.92
TPSA105.40 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.43
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-3-methylbenzamide
CID 121023120
3,4,5-triethoxy-N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]benzamide
CID 121198864
N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-4-thiophen-2-ylbenzamide
CID 119105875
N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-3,4,5-trimethoxybenzamide
CID 121198817
3-chloro-N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]benzamide
CID 121198851
5-fluoro-N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]pyridine-3-carboxamide
CID 119105906
N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-5-methylpyrazine-2-carboxamide
CID 119105889
N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-5-methylthiophene-2-carboxamide
CID 121198890
4-(dimethylsulfamoyl)-N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]benzamide
CID 5083850
1-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-3-propan-2-ylurea
CID 121199008
4-(dimethylsulfamoyl)-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]benzamide
CID 18118985
N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]naphthalene-1-carboxamide
CID 121198866

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylsulfamoyl)-N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]benzamide?
The IUPAC name of 4-(dimethylsulfamoyl)-N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]benzamide (CID 121198772) is 4-(dimethylsulfamoyl)-N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]benzamide.
What is the SMILES notation for 4-(dimethylsulfamoyl)-N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]benzamide?
The canonical SMILES for 4-(dimethylsulfamoyl)-N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]benzamide is CN(C)S(=O)(=O)c1ccc(C(=O)NCc2nccnc2-c2ccco2)cc1.
What is the InChIKey of 4-(dimethylsulfamoyl)-N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]benzamide?
The InChIKey is GUWDECLXQFEBSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O4S/c1-22(2)27(24,25)14-7-5-13(6-8-14)18(23)21-12-15-17(20-10-9-19-15)16-4-3-11-26-16/h3-11H,12H2,1-2H3,(H,21,23).
What are the key properties of 4-(dimethylsulfamoyl)-N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]benzamide?
4-(dimethylsulfamoyl)-N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]benzamide has a molecular weight of 386.43 g/mol, XLogP of 1.92, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylsulfamoyl)-N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]benzamide is sourced from PubChem (CID 121198772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).