Chemical Component Summary

Name6-[5-chloranyl-2-(oxan-4-ylamino)pyrimidin-4-yl]-2,3-dihydroisoindol-1-one
Identifiers6-[5-chloranyl-2-(oxan-4-ylamino)pyrimidin-4-yl]-2,3-dihydroisoindol-1-one
FormulaC17 H17 Cl N4 O2
Molecular Weight344.795
TypeNON-POLYMER
Isomeric SMILESc1cc2c(cc1c3c(cnc(n3)NC4CCOCC4)Cl)C(=O)NC2
InChIInChI=1S/C17H17ClN4O2/c18-14-9-20-17(21-12-3-5-24-6-4-12)22-15(14)10-1-2-11-8-19-16(23)13(11)7-10/h1-2,7,9,12H,3-6,8H2,(H,19,23)(H,20,21,22)
InChIKeyGIZKBEAJKWOWLS-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count41
Chiral Atom Count0
Bond Count44
Aromatic Bond Count12

Related Resource References

Resource NameReference
Pharos CHEMBL4204392
PubChem 129053223
ChEMBL CHEMBL4204392