N-(1-benzothiophen-6-ylsulfonyl)-2,4-dichlorobenzamide

C15H9Cl2NO3S2 — CID 10023015

IUPACN-(1-benzothiophen-6-ylsulfonyl)-2,4-dichlorobenzamide
SMILESO=C(NS(=O)(=O)c1ccc2ccsc2c1)c1ccc(Cl)cc1Cl
InChIInChI=1S/C15H9Cl2NO3S2/c16-10-2-4-12(13(17)7-10)15(19)18-23(20,21)11-3-1-9-5-6-22-14(9)8-11/h1-8H,(H,18,19)
InChIKeyWJGPBSGRYZBRTF-UHFFFAOYSA-N
MW386.28 g/mol
LogP4.33
Rot. Bonds3

About N-(1-benzothiophen-6-ylsulfonyl)-2,4-dichlorobenzamide

N-(1-benzothiophen-6-ylsulfonyl)-2,4-dichlorobenzamide (PubChem CID 10023015) has the molecular formula C15H9Cl2NO3S2 and a molecular weight of 386.28 g/mol. Its IUPAC name is N-(1-benzothiophen-6-ylsulfonyl)-2,4-dichlorobenzamide.

Molecular Properties

Compound NameN-(1-benzothiophen-6-ylsulfonyl)-2,4-dichlorobenzamide
PubChem CID10023015
Molecular FormulaC15H9Cl2NO3S2
Molecular Weight386.28 g/mol
Exact Mass384.94
IUPAC NameN-(1-benzothiophen-6-ylsulfonyl)-2,4-dichlorobenzamide
SMILESO=C(NS(=O)(=O)c1ccc2ccsc2c1)c1ccc(Cl)cc1Cl
InChIInChI=1S/C15H9Cl2NO3S2/c16-10-2-4-12(13(17)7-10)15(19)18-23(20,21)11-3-1-9-5-6-22-14(9)8-11/h1-8H,(H,18,19)
InChIKeyWJGPBSGRYZBRTF-UHFFFAOYSA-N
XLogP4.33
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.28
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Benzamide, N-(benzo[b]thien-2-ylsulfonyl)-2,4-dichloro-
CID 10068700
2,4-dichloro-N-thiophen-2-ylsulfonylbenzamide
CID 22019471
N-(1-benzothiophen-5-ylsulfonyl)-2,4-dichlorobenzamide
CID 44391088
N-(1-benzothiophen-4-ylsulfonyl)-2,4-dichlorobenzamide
CID 44391114
N-(1-benzothiophen-7-ylsulfonyl)-2,4-dichlorobenzamide
CID 44391121
2,4-dichloro-N-thiophen-3-ylsulfonylbenzohydrazide
CID 44391182
2-chloro-N-(thiophen-2-ylsulfonyl)benzamide
CID 975839
N-[(E)-2-(1-benzothiophen-3-yl)ethenyl]sulfonyl-2-chloro-4-fluorobenzamide
CID 16036234
3-[(2,4-dichloro-5-fluorophenyl)methyl]-2-methyl-N-pentylsulfonyl-1-benzothiophene-5-carboxamide
CID 22387996
N-[2-(1-benzothiophen-3-yl)ethenylsulfonyl]-2-chloro-4-fluorobenzamide
CID 68976913
3,6-dichloro-N-(5-chlorothiophen-2-yl)sulfonyl-1-benzothiophene-2-carboxamide
CID 4842698
N-(3-chloro-4-cyanophenyl)sulfonyl-4-fluoro-1-benzothiophene-2-carboxamide
CID 155946903

Frequently Asked Questions

What is the IUPAC name of N-(1-benzothiophen-6-ylsulfonyl)-2,4-dichlorobenzamide?
The IUPAC name of N-(1-benzothiophen-6-ylsulfonyl)-2,4-dichlorobenzamide (CID 10023015) is N-(1-benzothiophen-6-ylsulfonyl)-2,4-dichlorobenzamide.
What is the SMILES notation for N-(1-benzothiophen-6-ylsulfonyl)-2,4-dichlorobenzamide?
The canonical SMILES for N-(1-benzothiophen-6-ylsulfonyl)-2,4-dichlorobenzamide is O=C(NS(=O)(=O)c1ccc2ccsc2c1)c1ccc(Cl)cc1Cl.
What is the InChIKey of N-(1-benzothiophen-6-ylsulfonyl)-2,4-dichlorobenzamide?
The InChIKey is WJGPBSGRYZBRTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9Cl2NO3S2/c16-10-2-4-12(13(17)7-10)15(19)18-23(20,21)11-3-1-9-5-6-22-14(9)8-11/h1-8H,(H,18,19).
What are the key properties of N-(1-benzothiophen-6-ylsulfonyl)-2,4-dichlorobenzamide?
N-(1-benzothiophen-6-ylsulfonyl)-2,4-dichlorobenzamide has a molecular weight of 386.28 g/mol, XLogP of 4.33, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzothiophen-6-ylsulfonyl)-2,4-dichlorobenzamide is sourced from PubChem (CID 10023015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).