2-chloro-N-thiophen-2-ylsulfonylbenzamide

C11H8ClNO3S2 — CID 975839

IUPAC2-chloro-N-thiophen-2-ylsulfonylbenzamide
SMILESO=C(NS(=O)(=O)c1cccs1)c1ccccc1Cl
InChIInChI=1S/C11H8ClNO3S2/c12-9-5-2-1-4-8(9)11(14)13-18(15,16)10-6-3-7-17-10/h1-7H,(H,13,14)
InChIKeyQIZMZAYLRMMOAA-UHFFFAOYSA-N
MW301.78 g/mol
LogP2.52
Rot. Bonds3

About 2-chloro-N-thiophen-2-ylsulfonylbenzamide

2-chloro-N-thiophen-2-ylsulfonylbenzamide (PubChem CID 975839) has the molecular formula C11H8ClNO3S2 and a molecular weight of 301.78 g/mol. Its IUPAC name is 2-chloro-N-thiophen-2-ylsulfonylbenzamide.

Molecular Properties

Compound Name2-chloro-N-thiophen-2-ylsulfonylbenzamide
PubChem CID975839
Molecular FormulaC11H8ClNO3S2
Molecular Weight301.78 g/mol
Exact Mass300.96
IUPAC Name2-chloro-N-thiophen-2-ylsulfonylbenzamide
SMILESO=C(NS(=O)(=O)c1cccs1)c1ccccc1Cl
InChIInChI=1S/C11H8ClNO3S2/c12-9-5-2-1-4-8(9)11(14)13-18(15,16)10-6-3-7-17-10/h1-7H,(H,13,14)
InChIKeyQIZMZAYLRMMOAA-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

2-chloro-N-[2-[[4-(thiophen-2-ylsulfonylamino)benzoyl]amino]ethyl]benzamide
CID 55659204
thiophen-2-ylsulfonylurea;urea
CID 19065180
N-thiophen-2-ylsulfonylcyclopropanecarboxamide
CID 47232134
2-chloro-N-sulfamoylbenzamide
CID 54547559
(2R)-2-(2-chlorophenyl)-2-(thiophen-2-ylsulfonylamino)acetic acid
CID 107314977
1-(3,4-dichlorophenyl)-3-thiophen-2-ylsulfonylurea
CID 19089331
N-thiophen-2-ylsulfonylprop-2-enamide
CID 139972027
(1E)-2-chloro-N-thiophen-2-ylsulfonylbenzenecarboximidoyl chloride
CID 18871859
N-fluorothiophene-2-sulfonamide
CID 175398216
2-(thiophen-2-ylsulfonylamino)benzamide
CID 769135
4-chloro-N'-thiophen-2-ylsulfonylbenzohydrazide
CID 8500420
N'-hydroxythiophene-2-sulfonohydrazide
CID 67151955

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-thiophen-2-ylsulfonylbenzamide?
The IUPAC name of 2-chloro-N-thiophen-2-ylsulfonylbenzamide (CID 975839) is 2-chloro-N-thiophen-2-ylsulfonylbenzamide.
What is the SMILES notation for 2-chloro-N-thiophen-2-ylsulfonylbenzamide?
The canonical SMILES for 2-chloro-N-thiophen-2-ylsulfonylbenzamide is O=C(NS(=O)(=O)c1cccs1)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-thiophen-2-ylsulfonylbenzamide?
The InChIKey is QIZMZAYLRMMOAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8ClNO3S2/c12-9-5-2-1-4-8(9)11(14)13-18(15,16)10-6-3-7-17-10/h1-7H,(H,13,14).
What are the key properties of 2-chloro-N-thiophen-2-ylsulfonylbenzamide?
2-chloro-N-thiophen-2-ylsulfonylbenzamide 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 2-chloro-N-thiophen-2-ylsulfonylbenzamide is sourced from PubChem (CID 975839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).