93N

6-{4-[3-(4-methylpiperazin-1-yl)propoxy]-3-(trifluoromethyl)phenyl}pyridine-2-carbonitrile


Toggle HydrogenToggle Labels

Chemical Component Summary

Name6-{4-[3-(4-methylpiperazin-1-yl)propoxy]-3-(trifluoromethyl)phenyl}pyridine-2-carbonitrile
Identifiers6-[4-[3-(4-methylpiperazin-1-yl)propoxy]-3-(trifluoromethyl)phenyl]pyridine-2-carbonitrile
FormulaC21 H23 F3 N4 O
Molecular Weight404.429
TypeNON-POLYMER
Isomeric SMILESCN1CCN(CC1)CCCOc2ccc(cc2C(F)(F)F)c3cccc(n3)C#N
InChIInChI=1S/C21H23F3N4O/c1-27-9-11-28(12-10-27)8-3-13-29-20-7-6-16(14-18(20)21(22,23)24)19-5-2-4-17(15-25)26-19/h2,4-7,14H,3,8-13H2,1H3
InChIKeyCWICZCHZPOSFKO-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count52
Chiral Atom Count0
Bond Count54
Aromatic Bond Count13

Related Resource References

Resource NameReference
Pharos CHEMBL1209147
PubChem 46238539
ChEMBL CHEMBL1209147