N-[[5-(phenylsulfamoyl)thiophen-2-yl]methyl]benzamide

C18H16N2O3S2 — CID 2823706

IUPACN-[[5-(phenylsulfamoyl)thiophen-2-yl]methyl]benzamide
SMILESO=C(NCc1ccc(S(=O)(=O)Nc2ccccc2)s1)c1ccccc1
InChIInChI=1S/C18H16N2O3S2/c21-18(14-7-3-1-4-8-14)19-13-16-11-12-17(24-16)25(22,23)20-15-9-5-2-6-10-15/h1-12,20H,13H2,(H,19,21)
InChIKeyZJRRXDFXZYZXKS-UHFFFAOYSA-N
MW372.47 g/mol
LogP3.48
Rot. Bonds6

About N-[[5-(phenylsulfamoyl)thiophen-2-yl]methyl]benzamide

N-[[5-(phenylsulfamoyl)thiophen-2-yl]methyl]benzamide (PubChem CID 2823706) has the molecular formula C18H16N2O3S2 and a molecular weight of 372.47 g/mol. Its IUPAC name is N-[[5-(phenylsulfamoyl)thiophen-2-yl]methyl]benzamide.

Molecular Properties

Compound NameN-[[5-(phenylsulfamoyl)thiophen-2-yl]methyl]benzamide
PubChem CID2823706
Molecular FormulaC18H16N2O3S2
Molecular Weight372.47 g/mol
Exact Mass372.06
IUPAC NameN-[[5-(phenylsulfamoyl)thiophen-2-yl]methyl]benzamide
SMILESO=C(NCc1ccc(S(=O)(=O)Nc2ccccc2)s1)c1ccccc1
InChIInChI=1S/C18H16N2O3S2/c21-18(14-7-3-1-4-8-14)19-13-16-11-12-17(24-16)25(22,23)20-15-9-5-2-6-10-15/h1-12,20H,13H2,(H,19,21)
InChIKeyZJRRXDFXZYZXKS-UHFFFAOYSA-N
XLogP3.48
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.47
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 4-[[5-(benzamidomethyl)thiophen-2-yl]sulfonylamino]-2-hydroxybenzoate
CID 71612287
N-[[5-(cyclohexylsulfamoyl)thiophen-2-yl]methyl]benzamide
CID 2823724
N-[[5-(phenylsulfamoyl)thiophen-2-yl]methyl]-1λ3-iodacyclohepta-1,2,4,6-tetraene-4-carboxamide
CID 176526167
4-(benzenesulfonamido)-N-[(5-chlorothiophen-2-yl)methyl]benzamide
CID 32831454
N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]benzamide
CID 17440789
N-[[5-[[4-(4-amino-4H-furo[2,3-d]pyrimidin-3-yl)phenyl]sulfamoyl]thiophen-2-yl]methyl]benzamide
CID 69210192
N-[[5-[(4-methylphenyl)sulfamoyl]thiophen-2-yl]methyl]acetamide
CID 16553822
5-(2-aminoethyl)-N-phenylthiophene-2-sulfonamide
CID 43520785
N-[[5-[benzyl(propan-2-yl)sulfamoyl]thiophen-2-yl]methyl]benzamide
CID 2813898
N-[(5-acetylthiophen-2-yl)methyl]benzamide
CID 102052136
ethyl 4-[[5-(acetamidomethyl)thiophen-2-yl]sulfonylamino]benzoate
CID 16553849
N-[[5-[4-[2-(cyclohexylamino)ethylamino]butylsulfamoyl]thiophen-2-yl]methyl]benzamide
CID 139937739

Frequently Asked Questions

What is the IUPAC name of N-[[5-(phenylsulfamoyl)thiophen-2-yl]methyl]benzamide?
The IUPAC name of N-[[5-(phenylsulfamoyl)thiophen-2-yl]methyl]benzamide (CID 2823706) is N-[[5-(phenylsulfamoyl)thiophen-2-yl]methyl]benzamide.
What is the SMILES notation for N-[[5-(phenylsulfamoyl)thiophen-2-yl]methyl]benzamide?
The canonical SMILES for N-[[5-(phenylsulfamoyl)thiophen-2-yl]methyl]benzamide is O=C(NCc1ccc(S(=O)(=O)Nc2ccccc2)s1)c1ccccc1.
What is the InChIKey of N-[[5-(phenylsulfamoyl)thiophen-2-yl]methyl]benzamide?
The InChIKey is ZJRRXDFXZYZXKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O3S2/c21-18(14-7-3-1-4-8-14)19-13-16-11-12-17(24-16)25(22,23)20-15-9-5-2-6-10-15/h1-12,20H,13H2,(H,19,21).
What are the key properties of N-[[5-(phenylsulfamoyl)thiophen-2-yl]methyl]benzamide?
N-[[5-(phenylsulfamoyl)thiophen-2-yl]methyl]benzamide has a molecular weight of 372.47 g/mol, XLogP of 3.48, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(phenylsulfamoyl)thiophen-2-yl]methyl]benzamide is sourced from PubChem (CID 2823706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).