F2C

6-[2-(7-phenylheptanoyl)-1,3-oxazol-5-yl]pyridine-2-carboxylic acid

Created:2009-10-14
Last modified:  2024-09-27

Help

Find related ligands:

Chemical Details

Formal Charge0
Atom Count50
Chiral Atom Count0
Bond Count52
Aromatic Bond Count18
2D diagram of F2C

WebGL does not seem to be available.

This can be caused by an outdated browser, graphics card driver issue, or bad weather. Sometimes, just restarting the browser helps. Also, make sure hardware acceleration is enabled in your browser.

For a list of supported browsers, refer to http://caniuse.com/#feat=webgl.

Toggle HydrogenToggle Labels

Chemical Component Summary

Name6-[2-(7-phenylheptanoyl)-1,3-oxazol-5-yl]pyridine-2-carboxylic acid
Synonyms6-(2-(7-phenylheptanoyl)oxazol-5-yl)picolinate
Systematic Name (OpenEye OEToolkits)6-[2-(7-phenylheptanoyl)-1,3-oxazol-5-yl]pyridine-2-carboxylic acid
FormulaC22 H22 N2 O4
Molecular Weight378.421
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs11.02O=C(c1ncc(o1)c2nc(C(=O)O)ccc2)CCCCCCc3ccccc3
SMILESCACTVS3.352OC(=O)c1cccc(n1)c2oc(nc2)C(=O)CCCCCCc3ccccc3
SMILESOpenEye OEToolkits1.7.0c1ccc(cc1)CCCCCCC(=O)c2ncc(o2)c3cccc(n3)C(=O)O
Canonical SMILESCACTVS3.352 OC(=O)c1cccc(n1)c2oc(nc2)C(=O)CCCCCCc3ccccc3
Canonical SMILESOpenEye OEToolkits1.7.0 c1ccc(cc1)CCCCCCC(=O)c2ncc(o2)c3cccc(n3)C(=O)O
InChIInChI1.03 InChI=1S/C22H22N2O4/c25-19(14-7-2-1-4-9-16-10-5-3-6-11-16)21-23-15-20(28-21)17-12-8-13-18(24-17)22(26)27/h3,5-6,8,10-13,15H,1-2,4,7,9,14H2,(H,26,27)
InChIKeyInChI1.03 DZMRAEAGLIEJDZ-UHFFFAOYSA-N

Related Resource References

Resource NameReference
Pharos CHEMBL219942
PubChem 16110715
ChEMBL CHEMBL219942