4-(4-fluorophenyl)-2-(furan-2-ylsulfonyl)-3-pyridin-4-yl-1,2-oxazol-5-one

C18H11FN2O5S — CID 10200144

IUPAC4-(4-fluorophenyl)-2-(furan-2-ylsulfonyl)-3-pyridin-4-yl-1,2-oxazol-5-one
SMILESO=c1on(S(=O)(=O)c2ccco2)c(-c2ccncc2)c1-c1ccc(F)cc1
InChIInChI=1S/C18H11FN2O5S/c19-14-5-3-12(4-6-14)16-17(13-7-9-20-10-8-13)21(26-18(16)22)27(23,24)15-2-1-11-25-15/h1-11H
InChIKeyWZUWROPFTUOEHF-UHFFFAOYSA-N
MW386.36 g/mol
LogP3.14
Rot. Bonds4

About 4-(4-fluorophenyl)-2-(furan-2-ylsulfonyl)-3-pyridin-4-yl-1,2-oxazol-5-one

4-(4-fluorophenyl)-2-(furan-2-ylsulfonyl)-3-pyridin-4-yl-1,2-oxazol-5-one (PubChem CID 10200144) has the molecular formula C18H11FN2O5S and a molecular weight of 386.36 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-2-(furan-2-ylsulfonyl)-3-pyridin-4-yl-1,2-oxazol-5-one.

Molecular Properties

Compound Name4-(4-fluorophenyl)-2-(furan-2-ylsulfonyl)-3-pyridin-4-yl-1,2-oxazol-5-one
PubChem CID10200144
Molecular FormulaC18H11FN2O5S
Molecular Weight386.36 g/mol
Exact Mass386.04
IUPAC Name4-(4-fluorophenyl)-2-(furan-2-ylsulfonyl)-3-pyridin-4-yl-1,2-oxazol-5-one
SMILESO=c1on(S(=O)(=O)c2ccco2)c(-c2ccncc2)c1-c1ccc(F)cc1
InChIInChI=1S/C18H11FN2O5S/c19-14-5-3-12(4-6-14)16-17(13-7-9-20-10-8-13)21(26-18(16)22)27(23,24)15-2-1-11-25-15/h1-11H
InChIKeyWZUWROPFTUOEHF-UHFFFAOYSA-N
XLogP3.14
TPSA95.31 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.36
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-2-(furan-2-ylsulfonyl)-3-pyridin-4-yl-1,2-oxazol-5-one?
The IUPAC name of 4-(4-fluorophenyl)-2-(furan-2-ylsulfonyl)-3-pyridin-4-yl-1,2-oxazol-5-one (CID 10200144) is 4-(4-fluorophenyl)-2-(furan-2-ylsulfonyl)-3-pyridin-4-yl-1,2-oxazol-5-one.
What is the SMILES notation for 4-(4-fluorophenyl)-2-(furan-2-ylsulfonyl)-3-pyridin-4-yl-1,2-oxazol-5-one?
The canonical SMILES for 4-(4-fluorophenyl)-2-(furan-2-ylsulfonyl)-3-pyridin-4-yl-1,2-oxazol-5-one is O=c1on(S(=O)(=O)c2ccco2)c(-c2ccncc2)c1-c1ccc(F)cc1.
What is the InChIKey of 4-(4-fluorophenyl)-2-(furan-2-ylsulfonyl)-3-pyridin-4-yl-1,2-oxazol-5-one?
The InChIKey is WZUWROPFTUOEHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11FN2O5S/c19-14-5-3-12(4-6-14)16-17(13-7-9-20-10-8-13)21(26-18(16)22)27(23,24)15-2-1-11-25-15/h1-11H.
What are the key properties of 4-(4-fluorophenyl)-2-(furan-2-ylsulfonyl)-3-pyridin-4-yl-1,2-oxazol-5-one?
4-(4-fluorophenyl)-2-(furan-2-ylsulfonyl)-3-pyridin-4-yl-1,2-oxazol-5-one has a molecular weight of 386.36 g/mol, XLogP of 3.14, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-2-(furan-2-ylsulfonyl)-3-pyridin-4-yl-1,2-oxazol-5-one is sourced from PubChem (CID 10200144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).