4-[(3-methoxyphenyl)sulfamoyl]thiophene-2-carboxamide

C12H12N2O4S2 — CID 20900802

IUPAC4-[(3-methoxyphenyl)sulfamoyl]thiophene-2-carboxamide
SMILESCOc1cccc(NS(=O)(=O)c2csc(C(N)=O)c2)c1
InChIInChI=1S/C12H12N2O4S2/c1-18-9-4-2-3-8(5-9)14-20(16,17)10-6-11(12(13)15)19-7-10/h2-7,14H,1H3,(H2,13,15)
InChIKeySRTLGXRWSJHPHY-UHFFFAOYSA-N
MW312.37 g/mol
LogP1.66
Rot. Bonds5

About 4-[(3-methoxyphenyl)sulfamoyl]thiophene-2-carboxamide

4-[(3-methoxyphenyl)sulfamoyl]thiophene-2-carboxamide (PubChem CID 20900802) has the molecular formula C12H12N2O4S2 and a molecular weight of 312.37 g/mol. Its IUPAC name is 4-[(3-methoxyphenyl)sulfamoyl]thiophene-2-carboxamide.

Molecular Properties

Compound Name4-[(3-methoxyphenyl)sulfamoyl]thiophene-2-carboxamide
PubChem CID20900802
Molecular FormulaC12H12N2O4S2
Molecular Weight312.37 g/mol
Exact Mass312.02
IUPAC Name4-[(3-methoxyphenyl)sulfamoyl]thiophene-2-carboxamide
SMILESCOc1cccc(NS(=O)(=O)c2csc(C(N)=O)c2)c1
InChIInChI=1S/C12H12N2O4S2/c1-18-9-4-2-3-8(5-9)14-20(16,17)10-6-11(12(13)15)19-7-10/h2-7,14H,1H3,(H2,13,15)
InChIKeySRTLGXRWSJHPHY-UHFFFAOYSA-N
XLogP1.66
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[(3-methoxyphenyl)sulfamoyl]thiophene-2-carboxamide?
The IUPAC name of 4-[(3-methoxyphenyl)sulfamoyl]thiophene-2-carboxamide (CID 20900802) is 4-[(3-methoxyphenyl)sulfamoyl]thiophene-2-carboxamide.
What is the SMILES notation for 4-[(3-methoxyphenyl)sulfamoyl]thiophene-2-carboxamide?
The canonical SMILES for 4-[(3-methoxyphenyl)sulfamoyl]thiophene-2-carboxamide is COc1cccc(NS(=O)(=O)c2csc(C(N)=O)c2)c1.
What is the InChIKey of 4-[(3-methoxyphenyl)sulfamoyl]thiophene-2-carboxamide?
The InChIKey is SRTLGXRWSJHPHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O4S2/c1-18-9-4-2-3-8(5-9)14-20(16,17)10-6-11(12(13)15)19-7-10/h2-7,14H,1H3,(H2,13,15).
What are the key properties of 4-[(3-methoxyphenyl)sulfamoyl]thiophene-2-carboxamide?
4-[(3-methoxyphenyl)sulfamoyl]thiophene-2-carboxamide has a molecular weight of 312.37 g/mol, XLogP of 1.66, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-methoxyphenyl)sulfamoyl]thiophene-2-carboxamide is sourced from PubChem (CID 20900802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).