4-methoxy-N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)benzenesulfonamide

C19H19NO4S — CID 4984585

IUPAC4-methoxy-N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccc3oc4c(c3c2)CCCC4)cc1
InChIInChI=1S/C19H19NO4S/c1-23-14-7-9-15(10-8-14)25(21,22)20-13-6-11-19-17(12-13)16-4-2-3-5-18(16)24-19/h6-12,20H,2-5H2,1H3
InChIKeySBXFAGBYOQZAKG-UHFFFAOYSA-N
MW357.43 g/mol
LogP4.12
Rot. Bonds4

About 4-methoxy-N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)benzenesulfonamide

4-methoxy-N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)benzenesulfonamide (PubChem CID 4984585) has the molecular formula C19H19NO4S and a molecular weight of 357.43 g/mol. Its IUPAC name is 4-methoxy-N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)benzenesulfonamide.

Molecular Properties

Compound Name4-methoxy-N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)benzenesulfonamide
PubChem CID4984585
Molecular FormulaC19H19NO4S
Molecular Weight357.43 g/mol
Exact Mass357.10
IUPAC Name4-methoxy-N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccc3oc4c(c3c2)CCCC4)cc1
InChIInChI=1S/C19H19NO4S/c1-23-14-7-9-15(10-8-14)25(21,22)20-13-6-11-19-17(12-13)16-4-2-3-5-18(16)24-19/h6-12,20H,2-5H2,1H3
InChIKeySBXFAGBYOQZAKG-UHFFFAOYSA-N
XLogP4.12
TPSA68.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.43
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)benzenesulfonamide?
The IUPAC name of 4-methoxy-N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)benzenesulfonamide (CID 4984585) is 4-methoxy-N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)benzenesulfonamide.
What is the SMILES notation for 4-methoxy-N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)benzenesulfonamide?
The canonical SMILES for 4-methoxy-N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)benzenesulfonamide is COc1ccc(S(=O)(=O)Nc2ccc3oc4c(c3c2)CCCC4)cc1.
What is the InChIKey of 4-methoxy-N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)benzenesulfonamide?
The InChIKey is SBXFAGBYOQZAKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO4S/c1-23-14-7-9-15(10-8-14)25(21,22)20-13-6-11-19-17(12-13)16-4-2-3-5-18(16)24-19/h6-12,20H,2-5H2,1H3.
What are the key properties of 4-methoxy-N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)benzenesulfonamide?
4-methoxy-N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)benzenesulfonamide has a molecular weight of 357.43 g/mol, XLogP of 4.12, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)benzenesulfonamide is sourced from PubChem (CID 4984585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).