5E6

(1S,3S)-N-{6-[5-(pyridin-3-yl)-1H-pyrazolo[3,4-c]pyridin-3-yl]pyridin-2-yl}cyclohexane-1,3-diamine


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Chemical Component Summary

Name(1S,3S)-N-{6-[5-(pyridin-3-yl)-1H-pyrazolo[3,4-c]pyridin-3-yl]pyridin-2-yl}cyclohexane-1,3-diamine
Identifiers(1S,3S)-N1-[6-(5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)pyridin-2-yl]cyclohexane-1,3-diamine
FormulaC22 H23 N7
Molecular Weight385.465
TypeNON-POLYMER
Isomeric SMILESc1cc(nc(c1)N[C@H]2CCC[C@@H](C2)N)c3c4cc(ncc4[nH]n3)c5cccnc5
InChIInChI=1S/C22H23N7/c23-15-5-1-6-16(10-15)26-21-8-2-7-18(27-21)22-17-11-19(14-4-3-9-24-12-14)25-13-20(17)28-29-22/h2-4,7-9,11-13,15-16H,1,5-6,10,23H2,(H,26,27)(H,28,29)/t15-,16-/m0/s1
InChIKeyFWMVELRLCYRLLJ-HOTGVXAUSA-N

Chemical Details

Formal Charge0
Atom Count52
Chiral Atom Count2
Bond Count56
Aromatic Bond Count22

Related Resource References

Resource NameReference
Pharos CHEMBL3903896
PubChem 71253467
ChEMBL CHEMBL3903896