5-chloro-N-[2-[[4-(2-oxopyrazin-1-yl)phenyl]sulfamoyl]ethyl]thiophene-2-carboxamide

C17H15ClN4O4S2 — CID 134154940

IUPAC5-chloro-N-[2-[[4-(2-oxopyrazin-1-yl)phenyl]sulfamoyl]ethyl]thiophene-2-carboxamide
SMILESO=C(NCCS(=O)(=O)Nc1ccc(-n2ccncc2=O)cc1)c1ccc(Cl)s1
InChIInChI=1S/C17H15ClN4O4S2/c18-15-6-5-14(27-15)17(24)20-8-10-28(25,26)21-12-1-3-13(4-2-12)22-9-7-19-11-16(22)23/h1-7,9,11,21H,8,10H2,(H,20,24)
InChIKeyYSWODTNWYVODPG-UHFFFAOYSA-N
MW438.92 g/mol
LogP2.12
Rot. Bonds7

About 5-chloro-N-[2-[[4-(2-oxopyrazin-1-yl)phenyl]sulfamoyl]ethyl]thiophene-2-carboxamide

5-chloro-N-[2-[[4-(2-oxopyrazin-1-yl)phenyl]sulfamoyl]ethyl]thiophene-2-carboxamide (PubChem CID 134154940) has the molecular formula C17H15ClN4O4S2 and a molecular weight of 438.92 g/mol. Its IUPAC name is 5-chloro-N-[2-[[4-(2-oxopyrazin-1-yl)phenyl]sulfamoyl]ethyl]thiophene-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-[2-[[4-(2-oxopyrazin-1-yl)phenyl]sulfamoyl]ethyl]thiophene-2-carboxamide
PubChem CID134154940
Molecular FormulaC17H15ClN4O4S2
Molecular Weight438.92 g/mol
Exact Mass438.02
IUPAC Name5-chloro-N-[2-[[4-(2-oxopyrazin-1-yl)phenyl]sulfamoyl]ethyl]thiophene-2-carboxamide
SMILESO=C(NCCS(=O)(=O)Nc1ccc(-n2ccncc2=O)cc1)c1ccc(Cl)s1
InChIInChI=1S/C17H15ClN4O4S2/c18-15-6-5-14(27-15)17(24)20-8-10-28(25,26)21-12-1-3-13(4-2-12)22-9-7-19-11-16(22)23/h1-7,9,11,21H,8,10H2,(H,20,24)
InChIKeyYSWODTNWYVODPG-UHFFFAOYSA-N
XLogP2.12
TPSA110.16 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500438.92
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 5-chloro-N-[2-[[4-(2-oxopyrazin-1-yl)phenyl]sulfamoyl]ethyl]thiophene-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-chloro-N-[(1R,2S)-2-[[4-(2-oxopyrazin-1-yl)phenyl]carbamoyl]cyclopentyl]thiophene-2-carboxamide
CID 157373957
5-chloro-N-[(1R,2S)-2-[[4-(2-oxopyrazin-1-yl)benzoyl]amino]cyclopentyl]thiophene-2-carboxamide;sulfane
CID 169424051
5-chloro-N-[(3R,4S)-1-methyl-4-[[4-(2-oxopyrazin-1-yl)benzoyl]amino]pyrrolidin-3-yl]thiophene-2-carboxamide
CID 159112847
5-chloro-N-(2-imidazol-1-ylethyl)thiophene-2-carboxamide
CID 47143117
N-[2-[2-(5-chlorothiophen-2-yl)-2-oxoethyl]cyclopentyl]-4-(2-oxopyrazin-1-yl)benzamide
CID 18453267
N-[2-[(5-chlorothiophen-2-yl)sulfonylamino]-2-oxo-1-phenylethyl]-4-(2-oxopyrazin-1-yl)benzamide
CID 69439512
5-chloro-N-(3-pyrrol-1-ylpropyl)thiophene-2-carboxamide
CID 90500681
5-chloro-N-[2-[4-(5-chlorothiophene-2-carbonyl)piperazin-1-yl]sulfonylethyl]thiophene-2-carboxamide
CID 55862249
5-chloro-N-[[1-[4-(2-oxo-1-pyridinyl)phenyl]imidazol-4-yl]methyl]thiophene-2-carboxamide;methane
CID 159457229
5-chloro-N-[(2R)-3-methyl-1-oxo-1-[4-(2-oxo-1-pyridinyl)anilino]butan-2-yl]thiophene-2-carboxamide
CID 10002757
5-chloro-N-[[3-[4-(3-hydroxy-2-oxo-1-pyridinyl)phenyl]-5-methyl-4H-imidazol-5-yl]methyl]thiophene-2-carboxamide
CID 152992366
4-(2-oxopyrazin-1-yl)benzoic acid
CID 18453189

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[2-[[4-(2-oxopyrazin-1-yl)phenyl]sulfamoyl]ethyl]thiophene-2-carboxamide?
The IUPAC name of 5-chloro-N-[2-[[4-(2-oxopyrazin-1-yl)phenyl]sulfamoyl]ethyl]thiophene-2-carboxamide (CID 134154940) is 5-chloro-N-[2-[[4-(2-oxopyrazin-1-yl)phenyl]sulfamoyl]ethyl]thiophene-2-carboxamide.
What is the SMILES notation for 5-chloro-N-[2-[[4-(2-oxopyrazin-1-yl)phenyl]sulfamoyl]ethyl]thiophene-2-carboxamide?
The canonical SMILES for 5-chloro-N-[2-[[4-(2-oxopyrazin-1-yl)phenyl]sulfamoyl]ethyl]thiophene-2-carboxamide is O=C(NCCS(=O)(=O)Nc1ccc(-n2ccncc2=O)cc1)c1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N-[2-[[4-(2-oxopyrazin-1-yl)phenyl]sulfamoyl]ethyl]thiophene-2-carboxamide?
The InChIKey is YSWODTNWYVODPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClN4O4S2/c18-15-6-5-14(27-15)17(24)20-8-10-28(25,26)21-12-1-3-13(4-2-12)22-9-7-19-11-16(22)23/h1-7,9,11,21H,8,10H2,(H,20,24).
What are the key properties of 5-chloro-N-[2-[[4-(2-oxopyrazin-1-yl)phenyl]sulfamoyl]ethyl]thiophene-2-carboxamide?
5-chloro-N-[2-[[4-(2-oxopyrazin-1-yl)phenyl]sulfamoyl]ethyl]thiophene-2-carboxamide has a molecular weight of 438.92 g/mol, XLogP of 2.12, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[2-[[4-(2-oxopyrazin-1-yl)phenyl]sulfamoyl]ethyl]thiophene-2-carboxamide is sourced from PubChem (CID 134154940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).