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Chemical structure of Copanlisib dihydrochloride

GC60112

Copanlisib dihydrochloride

Also known as 2-amino-N-[7-methoxy-8-(3-morpholin-4-ylpropoxy)-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene]pyrimidine-5-carboxamide;dihydrochloride

Copanlisib dihydrochloride (BAY 80-6946 dihydrochloride) is a potent, selective and ATP-competitive pan-class I PI3K inhibitor, with IC50s of 0·5 nM, 0·7 nM, 3·7 nM and 6·4 nM for PI3Kα, PI3Kδ, PI3Kβ and PI3Kγ, respectively· Copanlisib dihydrochloride has more than 2,000-fold selectivity against other lipid and protein kinases, except for mTOR· Copanlisib dihydrochloride has superior antitumor activity

ChemicalCAS1402152-13-9MW553.44FormulaC23H30Cl2N8O4
CAS number
1402152-13-9
Molecular weight
553.44
Formula
C23H30Cl2N8O4
InChIKey
KWVVOPDWPMORCQ-UHFFFAOYSA-N
Catalogue number
GC60112
Brand
GLPBIO
Computed properties PubChem CID 135565785 · TPSA 140 Ų · H-bond donors 4 · H-bond acceptors 9
TPSA
140 Ų
H-bond donors
4
H-bond acceptors
9
Rotatable bonds
7
Heavy atoms
37

SMILES COC1=C(C=CC2=C3NCCN3C(=NC(=O)C4=CN=C(N=C4)N)N=C21)OCCCN5CCOCC5.Cl.Cl

Computed descriptors from PubChem (CID 135565785), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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