Chemical Component Summary

NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-{(2S)-1-[(6-fluoropyridin-3-yl)carbonyl]pyrrolidin-2-yl}pyrrolo[2,1-f][1,2,4]triazin-4-amine
Identifiers[(2S)-2-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]pyrrolidin-1-yl]-(6-fluoropyridin-3-yl)methanone
FormulaC22 H21 F N8 O
Molecular Weight432.454
TypeNON-POLYMER
Isomeric SMILESc1cc2c(nc(nn2c1)[C@@H]3CCCN3C(=O)c4ccc(nc4)F)Nc5cc([nH]n5)C6CC6
InChIInChI=1S/C22H21FN8O/c23-18-8-7-14(12-24-18)22(32)30-9-1-3-16(30)21-26-20(17-4-2-10-31(17)29-21)25-19-11-15(27-28-19)13-5-6-13/h2,4,7-8,10-13,16H,1,3,5-6,9H2,(H2,25,26,27,28,29)/t16-/m0/s1
InChIKeyXXGADWBTSMHVDF-INIZCTEOSA-N

Chemical Details

Formal Charge0
Atom Count53
Chiral Atom Count1
Bond Count58
Aromatic Bond Count21

Related Resource References

Resource NameReference
Pharos CHEMBL1222710
PubChem 25101485
ChEMBL CHEMBL1222710