7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonylpyrrolo[2,3-c]pyridine

C18H14N2O4S — CID 66757376

IUPAC7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonylpyrrolo[2,3-c]pyridine
SMILESCOc1ccc(S(=O)(=O)n2ccc3ccnc(-c4ccco4)c32)cc1
InChIInChI=1S/C18H14N2O4S/c1-23-14-4-6-15(7-5-14)25(21,22)20-11-9-13-8-10-19-17(18(13)20)16-3-2-12-24-16/h2-12H,1H3
InChIKeyIZAAPPPGNNSEMR-UHFFFAOYSA-N
MW354.39 g/mol
LogP3.54
Rot. Bonds4

About 7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonylpyrrolo[2,3-c]pyridine

7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonylpyrrolo[2,3-c]pyridine (PubChem CID 66757376) has the molecular formula C18H14N2O4S and a molecular weight of 354.39 g/mol. Its IUPAC name is 7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonylpyrrolo[2,3-c]pyridine.

Molecular Properties

Compound Name7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonylpyrrolo[2,3-c]pyridine
PubChem CID66757376
Molecular FormulaC18H14N2O4S
Molecular Weight354.39 g/mol
Exact Mass354.07
IUPAC Name7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonylpyrrolo[2,3-c]pyridine
SMILESCOc1ccc(S(=O)(=O)n2ccc3ccnc(-c4ccco4)c32)cc1
InChIInChI=1S/C18H14N2O4S/c1-23-14-4-6-15(7-5-14)25(21,22)20-11-9-13-8-10-19-17(18(13)20)16-3-2-12-24-16/h2-12H,1H3
InChIKeyIZAAPPPGNNSEMR-UHFFFAOYSA-N
XLogP3.54
TPSA74.33 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.39
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonylpyrrolo[2,3-c]pyridine?
The IUPAC name of 7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonylpyrrolo[2,3-c]pyridine (CID 66757376) is 7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonylpyrrolo[2,3-c]pyridine.
What is the SMILES notation for 7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonylpyrrolo[2,3-c]pyridine?
The canonical SMILES for 7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonylpyrrolo[2,3-c]pyridine is COc1ccc(S(=O)(=O)n2ccc3ccnc(-c4ccco4)c32)cc1.
What is the InChIKey of 7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonylpyrrolo[2,3-c]pyridine?
The InChIKey is IZAAPPPGNNSEMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2O4S/c1-23-14-4-6-15(7-5-14)25(21,22)20-11-9-13-8-10-19-17(18(13)20)16-3-2-12-24-16/h2-12H,1H3.
What are the key properties of 7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonylpyrrolo[2,3-c]pyridine?
7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonylpyrrolo[2,3-c]pyridine has a molecular weight of 354.39 g/mol, XLogP of 3.54, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(furan-2-yl)-1-(4-methoxyphenyl)sulfonylpyrrolo[2,3-c]pyridine is sourced from PubChem (CID 66757376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).