N-(5-chlorothiophen-2-yl)sulfonylbenzamide

C11H8ClNO3S2 — CID 753810

IUPACN-(5-chlorothiophen-2-yl)sulfonylbenzamide
SMILESO=C(NS(=O)(=O)c1ccc(Cl)s1)c1ccccc1
InChIInChI=1S/C11H8ClNO3S2/c12-9-6-7-10(17-9)18(15,16)13-11(14)8-4-2-1-3-5-8/h1-7H,(H,13,14)
InChIKeyBTWYTAFABDBTLE-UHFFFAOYSA-N
MW301.78 g/mol
LogP2.52
Rot. Bonds3

About N-(5-chlorothiophen-2-yl)sulfonylbenzamide

N-(5-chlorothiophen-2-yl)sulfonylbenzamide (PubChem CID 753810) has the molecular formula C11H8ClNO3S2 and a molecular weight of 301.78 g/mol. Its IUPAC name is N-(5-chlorothiophen-2-yl)sulfonylbenzamide.

Molecular Properties

Compound NameN-(5-chlorothiophen-2-yl)sulfonylbenzamide
PubChem CID753810
Molecular FormulaC11H8ClNO3S2
Molecular Weight301.78 g/mol
Exact Mass300.96
IUPAC NameN-(5-chlorothiophen-2-yl)sulfonylbenzamide
SMILESO=C(NS(=O)(=O)c1ccc(Cl)s1)c1ccccc1
InChIInChI=1S/C11H8ClNO3S2/c12-9-6-7-10(17-9)18(15,16)13-11(14)8-4-2-1-3-5-8/h1-7H,(H,13,14)
InChIKeyBTWYTAFABDBTLE-UHFFFAOYSA-N
XLogP2.52
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.78
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Tasisulam
CID 10160238
3-[(3,4-Dichlorobenzyl)sulfanyl]-N-(Methylsulfonyl)thiophene-2-Carboxamide
CID 54751676
4-(Benzylsulfamoyl)thiophene-2-carboxamide
CID 6486045
Benzamide, N-(benzo[b]thien-2-ylsulfonyl)-2,4-dichloro-
CID 10068700
2,4-dichloro-N-thiophen-2-ylsulfonylbenzamide
CID 22019471
N-(4-chlorophenyl)sulfonylbenzamide
CID 286220
4-[2-(4-Chlorophenyl)ethylsulfamoyl]thiophene-2-carboxamide
CID 20900804
2,4-dichloro-N-(5-chlorothiophen-2-yl)sulfonylbenzohydrazide
CID 44391208
2,4-dichloro-N-(4-chlorothiophen-2-yl)sulfonylbenzohydrazide
CID 44391209
2,4-dichloro-N-(5-methylthiophen-2-yl)sulfonylbenzohydrazide
CID 44391227
2,4-dichloro-N-(4-methylthiophen-2-yl)sulfonylbenzohydrazide
CID 44391245
2,4-dichloro-N-(5-ethylthiophen-2-yl)sulfonylbenzohydrazide
CID 44391246

Frequently Asked Questions

What is the IUPAC name of N-(5-chlorothiophen-2-yl)sulfonylbenzamide?
The IUPAC name of N-(5-chlorothiophen-2-yl)sulfonylbenzamide (CID 753810) is N-(5-chlorothiophen-2-yl)sulfonylbenzamide.
What is the SMILES notation for N-(5-chlorothiophen-2-yl)sulfonylbenzamide?
The canonical SMILES for N-(5-chlorothiophen-2-yl)sulfonylbenzamide is O=C(NS(=O)(=O)c1ccc(Cl)s1)c1ccccc1.
What is the InChIKey of N-(5-chlorothiophen-2-yl)sulfonylbenzamide?
The InChIKey is BTWYTAFABDBTLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8ClNO3S2/c12-9-6-7-10(17-9)18(15,16)13-11(14)8-4-2-1-3-5-8/h1-7H,(H,13,14).
What are the key properties of N-(5-chlorothiophen-2-yl)sulfonylbenzamide?
N-(5-chlorothiophen-2-yl)sulfonylbenzamide has a molecular weight of 301.78 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chlorothiophen-2-yl)sulfonylbenzamide is sourced from PubChem (CID 753810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).