Chemical Component Summary

Name1-(4-fluorophenyl)-5-[3-(1H-indol-3-yl)propoxy]-1H-pyrazole-4-carboxylic acid
Identifiers1-(4-fluorophenyl)-5-[3-(1~{H}-indol-3-yl)propoxy]pyrazole-4-carboxylic acid
FormulaC21 H18 F N3 O3
Molecular Weight379.384
TypeNON-POLYMER
Isomeric SMILESc1ccc2c(c1)c(c[nH]2)CCCOc3c(cnn3c4ccc(cc4)F)C(=O)O
InChIInChI=1S/C21H18FN3O3/c22-15-7-9-16(10-8-15)25-20(18(13-24-25)21(26)27)28-11-3-4-14-12-23-19-6-2-1-5-17(14)19/h1-2,5-10,12-13,23H,3-4,11H2,(H,26,27)
InChIKeyHECYVAQVQUQMCB-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count46
Chiral Atom Count0
Bond Count49
Aromatic Bond Count21

Related Resource References

Resource NameReference
PubChem 146675154