7-chloro-1-benzofuran-2-sulfonamide

C8H6ClNO3S — CID 114733064

IUPAC7-chloro-1-benzofuran-2-sulfonamide
SMILESNS(=O)(=O)c1cc2cccc(Cl)c2o1
InChIInChI=1S/C8H6ClNO3S/c9-6-3-1-2-5-4-7(13-8(5)6)14(10,11)12/h1-4H,(H2,10,11,12)
InChIKeyXAZCZZQOVKYMKT-UHFFFAOYSA-N
MW231.66 g/mol
LogP1.73
Rot. Bonds1

About 7-chloro-1-benzofuran-2-sulfonamide

7-chloro-1-benzofuran-2-sulfonamide (PubChem CID 114733064) has the molecular formula C8H6ClNO3S and a molecular weight of 231.66 g/mol. Its IUPAC name is 7-chloro-1-benzofuran-2-sulfonamide.

Molecular Properties

Compound Name7-chloro-1-benzofuran-2-sulfonamide
PubChem CID114733064
Molecular FormulaC8H6ClNO3S
Molecular Weight231.66 g/mol
Exact Mass230.98
IUPAC Name7-chloro-1-benzofuran-2-sulfonamide
SMILESNS(=O)(=O)c1cc2cccc(Cl)c2o1
InChIInChI=1S/C8H6ClNO3S/c9-6-3-1-2-5-4-7(13-8(5)6)14(10,11)12/h1-4H,(H2,10,11,12)
InChIKeyXAZCZZQOVKYMKT-UHFFFAOYSA-N
XLogP1.73
TPSA73.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.66
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-chloro-1-benzofuran-2-sulfonyl chloride
CID 83900451
(7-chloro-1-benzofuran-2-yl)methanamine
CID 65441087
7-chloro-2-(isocyanomethyl)-1-benzofuran
CID 83484072
(7-chloro-1-benzofuran-2-yl)-(2,6-dichlorophenyl)methanamine
CID 105048440
4-(7-chloro-1-benzofuran-2-yl)-3-fluoroaniline
CID 114732001
1-(7-chloro-1-benzofuran-2-yl)-2,2-difluoroethanamine
CID 103517192
7-(oxiran-2-ylmethoxy)-1-benzofuran-2-sulfonamide
CID 88622525
3-(7-chloro-1-benzofuran-2-yl)propanal
CID 114733142
(7-chloro-1-benzofuran-2-yl)-(3-chloro-2-fluorophenyl)methanone
CID 114725319
5-(7-chloro-1-benzofuran-2-yl)furan-2-carboxylic acid
CID 114731756
1-(7-chloro-1-benzofuran-2-yl)propan-2-amine
CID 114735430
2-(aminomethyl)-1-(7-chloro-1-benzofuran-2-yl)butan-1-one
CID 114736660

Frequently Asked Questions

What is the IUPAC name of 7-chloro-1-benzofuran-2-sulfonamide?
The IUPAC name of 7-chloro-1-benzofuran-2-sulfonamide (CID 114733064) is 7-chloro-1-benzofuran-2-sulfonamide.
What is the SMILES notation for 7-chloro-1-benzofuran-2-sulfonamide?
The canonical SMILES for 7-chloro-1-benzofuran-2-sulfonamide is NS(=O)(=O)c1cc2cccc(Cl)c2o1.
What is the InChIKey of 7-chloro-1-benzofuran-2-sulfonamide?
The InChIKey is XAZCZZQOVKYMKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6ClNO3S/c9-6-3-1-2-5-4-7(13-8(5)6)14(10,11)12/h1-4H,(H2,10,11,12).
What are the key properties of 7-chloro-1-benzofuran-2-sulfonamide?
7-chloro-1-benzofuran-2-sulfonamide has a molecular weight of 231.66 g/mol, XLogP of 1.73, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-1-benzofuran-2-sulfonamide is sourced from PubChem (CID 114733064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).