7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonyl-2,3-dihydroindole

C19H17NO4S — CID 66757469

IUPAC7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonyl-2,3-dihydroindole
SMILESCOc1ccc(S(=O)(=O)N2CCc3cccc(-c4ccco4)c32)cc1
InChIInChI=1S/C19H17NO4S/c1-23-15-7-9-16(10-8-15)25(21,22)20-12-11-14-4-2-5-17(19(14)20)18-6-3-13-24-18/h2-10,13H,11-12H2,1H3
InChIKeyMNGBLYPBBFKPOD-UHFFFAOYSA-N
MW355.42 g/mol
LogP3.71
Rot. Bonds4

About 7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonyl-2,3-dihydroindole

7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonyl-2,3-dihydroindole (PubChem CID 66757469) has the molecular formula C19H17NO4S and a molecular weight of 355.42 g/mol. Its IUPAC name is 7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonyl-2,3-dihydroindole.

Molecular Properties

Compound Name7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonyl-2,3-dihydroindole
PubChem CID66757469
Molecular FormulaC19H17NO4S
Molecular Weight355.42 g/mol
Exact Mass355.09
IUPAC Name7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonyl-2,3-dihydroindole
SMILESCOc1ccc(S(=O)(=O)N2CCc3cccc(-c4ccco4)c32)cc1
InChIInChI=1S/C19H17NO4S/c1-23-15-7-9-16(10-8-15)25(21,22)20-12-11-14-4-2-5-17(19(14)20)18-6-3-13-24-18/h2-10,13H,11-12H2,1H3
InChIKeyMNGBLYPBBFKPOD-UHFFFAOYSA-N
XLogP3.71
TPSA59.75 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.42
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-fluoro-N-[1-(4-methoxyphenyl)sulfonyl-2,3-dihydroindol-7-yl]benzenesulfonamide
CID 24993539
4-cyano-N-[1-(4-methoxyphenyl)sulfonyl-2,3-dihydroindol-7-yl]benzamide
CID 24993216
5-fluoro-1-(4-methoxyphenyl)sulfonyl-2,3-dihydroindole
CID 3575663
4-[(7-pyridin-4-yl-2,3-dihydroindol-1-yl)sulfonyl]benzenesulfonamide
CID 66757544
2-(4-methylphenyl)sulfonyl-3,4-dihydroisoquinolin-1-one
CID 11472135
7-methoxy-1-(4-methoxyphenyl)sulfonyl-2,3-dihydroquinolin-4-one
CID 110635683
1-(4-fluorophenyl)sulfonyl-8-methoxy-2,3-dihydroquinolin-4-one
CID 110635382
1-[4-[4-(2,3-dihydroindol-1-ylsulfonyl)phenoxy]phenyl]sulfonyl-2,3-dihydroindole
CID 91670097
1-(3,5-dimethylphenyl)sulfonyl-2,3-dihydroindol-7-amine
CID 114456013
N-[1-(4-methoxyphenyl)sulfonyl-3,4-dihydro-2H-quinolin-6-yl]furan-2-carboxamide
CID 27443601
(4-methoxyphenyl) 3-(2,3-dihydroindol-1-ylsulfonyl)benzoate
CID 8881484
(2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)sulfonyl-1,3-thiazolidine
CID 1084382

Frequently Asked Questions

What is the IUPAC name of 7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonyl-2,3-dihydroindole?
The IUPAC name of 7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonyl-2,3-dihydroindole (CID 66757469) is 7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonyl-2,3-dihydroindole.
What is the SMILES notation for 7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonyl-2,3-dihydroindole?
The canonical SMILES for 7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonyl-2,3-dihydroindole is COc1ccc(S(=O)(=O)N2CCc3cccc(-c4ccco4)c32)cc1.
What is the InChIKey of 7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonyl-2,3-dihydroindole?
The InChIKey is MNGBLYPBBFKPOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO4S/c1-23-15-7-9-16(10-8-15)25(21,22)20-12-11-14-4-2-5-17(19(14)20)18-6-3-13-24-18/h2-10,13H,11-12H2,1H3.
What are the key properties of 7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonyl-2,3-dihydroindole?
7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonyl-2,3-dihydroindole has a molecular weight of 355.42 g/mol, XLogP of 3.71, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonyl-2,3-dihydroindole is sourced from PubChem (CID 66757469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).