N-[3-[(4-chlorophenyl)sulfamoyl]-4-methoxyphenyl]-2-thiophen-2-ylacetamide

C19H17ClN2O4S2 — CID 4516891

IUPACN-[3-[(4-chlorophenyl)sulfamoyl]-4-methoxyphenyl]-2-thiophen-2-ylacetamide
SMILESCOc1ccc(NC(=O)Cc2cccs2)cc1S(=O)(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C19H17ClN2O4S2/c1-26-17-9-8-15(21-19(23)12-16-3-2-10-27-16)11-18(17)28(24,25)22-14-6-4-13(20)5-7-14/h2-11,22H,12H2,1H3,(H,21,23)
InChIKeyWAAUNVPAILTTAZ-UHFFFAOYSA-N
MW436.94 g/mol
LogP4.39
Rot. Bonds7

About N-[3-[(4-chlorophenyl)sulfamoyl]-4-methoxyphenyl]-2-thiophen-2-ylacetamide

N-[3-[(4-chlorophenyl)sulfamoyl]-4-methoxyphenyl]-2-thiophen-2-ylacetamide (PubChem CID 4516891) has the molecular formula C19H17ClN2O4S2 and a molecular weight of 436.94 g/mol. Its IUPAC name is N-[3-[(4-chlorophenyl)sulfamoyl]-4-methoxyphenyl]-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-[3-[(4-chlorophenyl)sulfamoyl]-4-methoxyphenyl]-2-thiophen-2-ylacetamide
PubChem CID4516891
Molecular FormulaC19H17ClN2O4S2
Molecular Weight436.94 g/mol
Exact Mass436.03
IUPAC NameN-[3-[(4-chlorophenyl)sulfamoyl]-4-methoxyphenyl]-2-thiophen-2-ylacetamide
SMILESCOc1ccc(NC(=O)Cc2cccs2)cc1S(=O)(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C19H17ClN2O4S2/c1-26-17-9-8-15(21-19(23)12-16-3-2-10-27-16)11-18(17)28(24,25)22-14-6-4-13(20)5-7-14/h2-11,22H,12H2,1H3,(H,21,23)
InChIKeyWAAUNVPAILTTAZ-UHFFFAOYSA-N
XLogP4.39
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.94
LogP ≤ 54.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[3-[(4-chlorophenyl)sulfamoyl]-4-methoxyphenyl]-2-thiophen-2-ylacetamide?
The IUPAC name of N-[3-[(4-chlorophenyl)sulfamoyl]-4-methoxyphenyl]-2-thiophen-2-ylacetamide (CID 4516891) is N-[3-[(4-chlorophenyl)sulfamoyl]-4-methoxyphenyl]-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-[3-[(4-chlorophenyl)sulfamoyl]-4-methoxyphenyl]-2-thiophen-2-ylacetamide?
The canonical SMILES for N-[3-[(4-chlorophenyl)sulfamoyl]-4-methoxyphenyl]-2-thiophen-2-ylacetamide is COc1ccc(NC(=O)Cc2cccs2)cc1S(=O)(=O)Nc1ccc(Cl)cc1.
What is the InChIKey of N-[3-[(4-chlorophenyl)sulfamoyl]-4-methoxyphenyl]-2-thiophen-2-ylacetamide?
The InChIKey is WAAUNVPAILTTAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN2O4S2/c1-26-17-9-8-15(21-19(23)12-16-3-2-10-27-16)11-18(17)28(24,25)22-14-6-4-13(20)5-7-14/h2-11,22H,12H2,1H3,(H,21,23).
What are the key properties of N-[3-[(4-chlorophenyl)sulfamoyl]-4-methoxyphenyl]-2-thiophen-2-ylacetamide?
N-[3-[(4-chlorophenyl)sulfamoyl]-4-methoxyphenyl]-2-thiophen-2-ylacetamide has a molecular weight of 436.94 g/mol, XLogP of 4.39, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(4-chlorophenyl)sulfamoyl]-4-methoxyphenyl]-2-thiophen-2-ylacetamide is sourced from PubChem (CID 4516891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).