Chemical Component Summary

Name3-{5-oxo-3-[1-(piperidin-4-yl)-1H-pyrazol-4-yl]-5H-benzo[4,5]cyclohepta[1,2-b]pyridin-7-yl}-N-(pyridin-2-ylmethyl)propanamide
Identifiersn/a
FormulaC31 H30 N6 O2
Molecular Weight518.609
TypeNON-POLYMER
Isomeric SMILESc1ccnc(c1)CNC(=O)CCc2ccc3c(c2)C(=O)c4cc(cnc4C=C3)c5cnn(c5)C6CCNCC6
InChIInChI=1S/C31H30N6O2/c38-30(35-19-25-3-1-2-12-33-25)9-5-21-4-6-22-7-8-29-28(31(39)27(22)15-21)16-23(17-34-29)24-18-36-37(20-24)26-10-13-32-14-11-26/h1-4,6-8,12,15-18,20,26,32H,5,9-11,13-14,19H2,(H,35,38)
InChIKeyPCKOOTOQVCFRHS-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count69
Chiral Atom Count0
Bond Count74
Aromatic Bond Count24

Related Resource References

Resource NameReference
Pharos CHEMBL1615181
PubChem 49837887
ChEMBL CHEMBL1615181