7-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-5-phenyl-1,6-naphthyridin-8-ol

C23H15FN4O2 — CID 135869527

IUPAC7-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-5-phenyl-1,6-naphthyridin-8-ol
SMILESOc1c(-c2nnc(Cc3ccc(F)cc3)o2)nc(-c2ccccc2)c2cccnc12
InChIInChI=1S/C23H15FN4O2/c24-16-10-8-14(9-11-16)13-18-27-28-23(30-18)21-22(29)20-17(7-4-12-25-20)19(26-21)15-5-2-1-3-6-15/h1-12,29H,13H2
InChIKeyWAVJGSJSVSZKKY-UHFFFAOYSA-N
MW398.40 g/mol
LogP4.78
Rot. Bonds4

About 7-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-5-phenyl-1,6-naphthyridin-8-ol

7-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-5-phenyl-1,6-naphthyridin-8-ol (PubChem CID 135869527) has the molecular formula C23H15FN4O2 and a molecular weight of 398.40 g/mol. Its IUPAC name is 7-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-5-phenyl-1,6-naphthyridin-8-ol.

Molecular Properties

Compound Name7-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-5-phenyl-1,6-naphthyridin-8-ol
PubChem CID135869527
Molecular FormulaC23H15FN4O2
Molecular Weight398.40 g/mol
Exact Mass398.12
IUPAC Name7-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-5-phenyl-1,6-naphthyridin-8-ol
SMILESOc1c(-c2nnc(Cc3ccc(F)cc3)o2)nc(-c2ccccc2)c2cccnc12
InChIInChI=1S/C23H15FN4O2/c24-16-10-8-14(9-11-16)13-18-27-28-23(30-18)21-22(29)20-17(7-4-12-25-20)19(26-21)15-5-2-1-3-6-15/h1-12,29H,13H2
InChIKeyWAVJGSJSVSZKKY-UHFFFAOYSA-N
XLogP4.78
TPSA84.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.40
LogP ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-5-phenyl-1,6-naphthyridin-8-ol?
The IUPAC name of 7-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-5-phenyl-1,6-naphthyridin-8-ol (CID 135869527) is 7-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-5-phenyl-1,6-naphthyridin-8-ol.
What is the SMILES notation for 7-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-5-phenyl-1,6-naphthyridin-8-ol?
The canonical SMILES for 7-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-5-phenyl-1,6-naphthyridin-8-ol is Oc1c(-c2nnc(Cc3ccc(F)cc3)o2)nc(-c2ccccc2)c2cccnc12.
What is the InChIKey of 7-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-5-phenyl-1,6-naphthyridin-8-ol?
The InChIKey is WAVJGSJSVSZKKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H15FN4O2/c24-16-10-8-14(9-11-16)13-18-27-28-23(30-18)21-22(29)20-17(7-4-12-25-20)19(26-21)15-5-2-1-3-6-15/h1-12,29H,13H2.
What are the key properties of 7-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-5-phenyl-1,6-naphthyridin-8-ol?
7-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-5-phenyl-1,6-naphthyridin-8-ol has a molecular weight of 398.40 g/mol, XLogP of 4.78, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-5-phenyl-1,6-naphthyridin-8-ol is sourced from PubChem (CID 135869527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).