2-chloro-N-[4-(4-chlorophenyl)sulfonylthiophen-3-yl]benzamide

C17H11Cl2NO3S2 — CID 2819398

IUPAC2-chloro-N-[4-(4-chlorophenyl)sulfonylthiophen-3-yl]benzamide
SMILESO=C(Nc1cscc1S(=O)(=O)c1ccc(Cl)cc1)c1ccccc1Cl
InChIInChI=1S/C17H11Cl2NO3S2/c18-11-5-7-12(8-6-11)25(22,23)16-10-24-9-15(16)20-17(21)13-3-1-2-4-14(13)19/h1-10H,(H,20,21)
InChIKeyFFIJENGMWVXXJI-UHFFFAOYSA-N
MW412.32 g/mol
LogP5.14
Rot. Bonds4

About 2-chloro-N-[4-(4-chlorophenyl)sulfonylthiophen-3-yl]benzamide

2-chloro-N-[4-(4-chlorophenyl)sulfonylthiophen-3-yl]benzamide (PubChem CID 2819398) has the molecular formula C17H11Cl2NO3S2 and a molecular weight of 412.32 g/mol. Its IUPAC name is 2-chloro-N-[4-(4-chlorophenyl)sulfonylthiophen-3-yl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[4-(4-chlorophenyl)sulfonylthiophen-3-yl]benzamide
PubChem CID2819398
Molecular FormulaC17H11Cl2NO3S2
Molecular Weight412.32 g/mol
Exact Mass410.96
IUPAC Name2-chloro-N-[4-(4-chlorophenyl)sulfonylthiophen-3-yl]benzamide
SMILESO=C(Nc1cscc1S(=O)(=O)c1ccc(Cl)cc1)c1ccccc1Cl
InChIInChI=1S/C17H11Cl2NO3S2/c18-11-5-7-12(8-6-11)25(22,23)16-10-24-9-15(16)20-17(21)13-3-1-2-4-14(13)19/h1-10H,(H,20,21)
InChIKeyFFIJENGMWVXXJI-UHFFFAOYSA-N
XLogP5.14
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500412.32
LogP ≤ 55.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-bromo-4-(phenylsulfonyl)-3-thienyl]-2-chlorobenzamide
CID 2819453
3-chloro-N-{4-chloro-2-[(4-chlorophenyl)carbamoyl]phenyl}-4-(methanesulfinylmethyl)thiophene-2-carboxamide
CID 10028986
3-chloro-N-{4-chloro-2-[(4-chlorophenyl)carbamoyl]phenyl}-4-(methanesulfonylmethyl)thiophene-2-carboxamide
CID 18376871
N-(5-chlorothiophen-3-yl)benzamide
CID 901515
2-{[(5-chloro-2-thienyl)sulfonyl]amino}-N-phenylbenzamide
CID 2200848
N-{3-[(2-chlorobenzoyl)amino]phenyl}-2-thiophenecarboxamide
CID 1164617
N1-[4-(phenylsulfonyl)-3-thienyl]-2-chlorobenzamide
CID 2819452
2-chloro-N-(2-methylphenyl)-5-(phenylsulfonyl)benzamide
CID 992292
N-(4-{[(4-chlorophenyl)acetyl]amino}phenyl)thiophene-2-carboxamide
CID 1347156
N-(3-chlorophenyl)-4-fluoro-3-(thiophen-2-ylmethylsulfamoyl)benzamide
CID 4229681
2-chloro-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-5-[methyl(phenyl)sulfamoyl]benzamide
CID 6363634
4-[(4-chlorophenyl)sulfonylamino]-N-thiophen-2-ylbenzamide
CID 44450759

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[4-(4-chlorophenyl)sulfonylthiophen-3-yl]benzamide?
The IUPAC name of 2-chloro-N-[4-(4-chlorophenyl)sulfonylthiophen-3-yl]benzamide (CID 2819398) is 2-chloro-N-[4-(4-chlorophenyl)sulfonylthiophen-3-yl]benzamide.
What is the SMILES notation for 2-chloro-N-[4-(4-chlorophenyl)sulfonylthiophen-3-yl]benzamide?
The canonical SMILES for 2-chloro-N-[4-(4-chlorophenyl)sulfonylthiophen-3-yl]benzamide is O=C(Nc1cscc1S(=O)(=O)c1ccc(Cl)cc1)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-[4-(4-chlorophenyl)sulfonylthiophen-3-yl]benzamide?
The InChIKey is FFIJENGMWVXXJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11Cl2NO3S2/c18-11-5-7-12(8-6-11)25(22,23)16-10-24-9-15(16)20-17(21)13-3-1-2-4-14(13)19/h1-10H,(H,20,21).
What are the key properties of 2-chloro-N-[4-(4-chlorophenyl)sulfonylthiophen-3-yl]benzamide?
2-chloro-N-[4-(4-chlorophenyl)sulfonylthiophen-3-yl]benzamide has a molecular weight of 412.32 g/mol, XLogP of 5.14, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[4-(4-chlorophenyl)sulfonylthiophen-3-yl]benzamide is sourced from PubChem (CID 2819398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).