QQ2

[(2-CHLORO-5-METHYLPHENYL){6-[(4-{[(2R)-3-(DIMETHYLAMINO)-2-HYDROXYPROPYL]OXY}PHENYL)AMINO]PYRIMIDIN-4-YL}AMINO]ACETONITRILE



Chemical Component Summary

Name[(2-CHLORO-5-METHYLPHENYL){6-[(4-{[(2R)-3-(DIMETHYLAMINO)-2-HYDROXYPROPYL]OXY}PHENYL)AMINO]PYRIMIDIN-4-YL}AMINO]ACETONITRILE
Identifiers2-[(2-chloro-5-methyl-phenyl)-[6-[[4-[(2R)-3-dimethylamino-2-hydroxy-propoxy]phenyl]amino]pyrimidin-4-yl]amino]ethanenitrile
FormulaC24 H27 Cl N6 O2
Molecular Weight466.963
TypeNON-POLYMER
Isomeric SMILESCc1ccc(c(c1)N(CC#N)c2cc(ncn2)Nc3ccc(cc3)OC[C@@H](CN(C)C)O)Cl
InChIInChI=1S/C24H27ClN6O2/c1-17-4-9-21(25)22(12-17)31(11-10-26)24-13-23(27-16-28-24)29-18-5-7-20(8-6-18)33-15-19(32)14-30(2)3/h4-9,12-13,16,19,32H,11,14-15H2,1-3H3,(H,27,28,29)/t19-/m1/s1
InChIKeyFIRZNFNHYVXQPP-LJQANCHMSA-N

Chemical Details

Formal Charge0
Atom Count60
Chiral Atom Count1
Bond Count62
Aromatic Bond Count18

Related Resource References

Resource NameReference
PubChem 9549254