2-chloro-N-(2,3-dihydro-1-benzofuran-3-yl)benzenesulfonamide

C14H12ClNO3S — CID 110751703

IUPAC2-chloro-N-(2,3-dihydro-1-benzofuran-3-yl)benzenesulfonamide
SMILESO=S(=O)(NC1COc2ccccc21)c1ccccc1Cl
InChIInChI=1S/C14H12ClNO3S/c15-11-6-2-4-8-14(11)20(17,18)16-12-9-19-13-7-3-1-5-10(12)13/h1-8,12,16H,9H2
InChIKeyXSZOIORYZKOVQT-UHFFFAOYSA-N
MW309.77 g/mol
LogP2.75
Rot. Bonds3

About 2-chloro-N-(2,3-dihydro-1-benzofuran-3-yl)benzenesulfonamide

2-chloro-N-(2,3-dihydro-1-benzofuran-3-yl)benzenesulfonamide (PubChem CID 110751703) has the molecular formula C14H12ClNO3S and a molecular weight of 309.77 g/mol. Its IUPAC name is 2-chloro-N-(2,3-dihydro-1-benzofuran-3-yl)benzenesulfonamide.

Molecular Properties

Compound Name2-chloro-N-(2,3-dihydro-1-benzofuran-3-yl)benzenesulfonamide
PubChem CID110751703
Molecular FormulaC14H12ClNO3S
Molecular Weight309.77 g/mol
Exact Mass309.02
IUPAC Name2-chloro-N-(2,3-dihydro-1-benzofuran-3-yl)benzenesulfonamide
SMILESO=S(=O)(NC1COc2ccccc21)c1ccccc1Cl
InChIInChI=1S/C14H12ClNO3S/c15-11-6-2-4-8-14(11)20(17,18)16-12-9-19-13-7-3-1-5-10(12)13/h1-8,12,16H,9H2
InChIKeyXSZOIORYZKOVQT-UHFFFAOYSA-N
XLogP2.75
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.77
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-[(3S)-3,4-dihydro-2H-chromen-3-yl]benzenesulfonamide
CID 94064806
5,6-dichloro-N-(2,3-dihydro-1-benzofuran-3-yl)pyridine-3-sulfonamide
CID 64608045
2-bromo-N-(2,3-dihydro-1-benzofuran-3-yl)-4-methylbenzenesulfonamide
CID 62066677
N-(2,3-dihydro-1-benzofuran-3-yl)ethanesulfonamide
CID 62065932
3-(dimethylsulfamoylamino)-2,3-dihydro-1-benzofuran
CID 110751655
N-(2,3-dihydro-1-benzofuran-3-yl)propane-2-sulfonamide
CID 62066112
2-chloro-N-(3,4-dihydro-2H-chromen-4-ylmethyl)benzenesulfonamide
CID 110709330
2,3-dihydro-1-benzofuran-3-ylurea
CID 62065035
N-(2-bromo-2,3-dihydro-1H-inden-1-yl)-2-chlorobenzenesulfonamide
CID 114297947
(3S)-3-[[cyclohexyl(methyl)sulfamoyl]amino]-2,3-dihydro-1-benzofuran
CID 95592046
3-chloro-1-N-(2,3-dihydro-1-benzofuran-3-yl)benzene-1,2-diamine
CID 104834591
N-(2,3-dihydro-1-benzofuran-3-yl)-5-(pyrrolidine-1-carbonyl)-1H-pyrrole-3-sulfonamide
CID 119032421

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(2,3-dihydro-1-benzofuran-3-yl)benzenesulfonamide?
The IUPAC name of 2-chloro-N-(2,3-dihydro-1-benzofuran-3-yl)benzenesulfonamide (CID 110751703) is 2-chloro-N-(2,3-dihydro-1-benzofuran-3-yl)benzenesulfonamide.
What is the SMILES notation for 2-chloro-N-(2,3-dihydro-1-benzofuran-3-yl)benzenesulfonamide?
The canonical SMILES for 2-chloro-N-(2,3-dihydro-1-benzofuran-3-yl)benzenesulfonamide is O=S(=O)(NC1COc2ccccc21)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-(2,3-dihydro-1-benzofuran-3-yl)benzenesulfonamide?
The InChIKey is XSZOIORYZKOVQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClNO3S/c15-11-6-2-4-8-14(11)20(17,18)16-12-9-19-13-7-3-1-5-10(12)13/h1-8,12,16H,9H2.
What are the key properties of 2-chloro-N-(2,3-dihydro-1-benzofuran-3-yl)benzenesulfonamide?
2-chloro-N-(2,3-dihydro-1-benzofuran-3-yl)benzenesulfonamide has a molecular weight of 309.77 g/mol, XLogP of 2.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(2,3-dihydro-1-benzofuran-3-yl)benzenesulfonamide is sourced from PubChem (CID 110751703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).