Copanlisib dihydrochlorideProduct ingredient for Copanlisib
- Name
- Copanlisib dihydrochloride
- Drug Entry
- Copanlisib
Copanlisib is a selective pan-Class I phosphoinositide 3-kinase (PI3K) inhibitor with preferential activity against the alpha and delta isoforms. PI3K, a lipid kinase that activates downstream signalling pathways involved in cell survival and growth, that exists in different isoforms and is often overexpressed in hematological malignancies.2 Copanlisib was granted accelerated approval by the FDA in September 2017 for the treatment of follicular lymphoma.1
- Accession Number
- DBSALT002581
- Structure
Structure for Copanlisib dihydrochloride (DBSALT002581)
- Synonyms
- 2-Amino-N-{7-methoxy-8-[3-(morpholin-4-yl)propoxy]-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl}pyrimidine-5-carboxamide dihydrochloride / 5-PYRIMIDINECARBOXAMIDE, 2-AMINO-N-(2,3-DIHYDRO-7-METHOXY-8-(3-(4-MORPHOLINYL)PROPOXY)IMIDAZO(1,2-C)QUINAZOLIN-5-YL)-, HYDROCHLORIDE (1:2) / BAY 80-6946 DIHYDROCHLORIDE / BAY-80-6946 DIHYDROCHLORIDE / Copanlisib HCl / Copanlisib hydrochloride / COPANLISIB HYDROCHLORIDE ANHYDROUS
- External IDs
- BAY 84-1236 / BAY-84-1236
- UNII
- 03ZI7RZ52O
- CAS Number
- 1402152-13-9
- Weight
- Average: 553.45
Monoisotopic: 552.1767069 - Chemical Formula
- C23H30Cl2N8O4
- InChI Key
- STGQPVQAAFJJFX-UHFFFAOYSA-N
- InChI
- InChI=1S/C23H28N8O4.2ClH/c1-33-19-17(35-10-2-6-30-8-11-34-12-9-30)4-3-16-18(19)28-23(31-7-5-25-20(16)31)29-21(32)15-13-26-22(24)27-14-15;;/h3-4,13-14H,2,5-12H2,1H3,(H2,24,26,27)(H,28,29,32);2*1H
- IUPAC Name
- 2-amino-N-{7-methoxy-8-[3-(morpholin-4-yl)propoxy]-2H,3H-imidazo[1,2-c]quinazolin-5-yl}pyrimidine-5-carboxamide dihydrochloride
- SMILES
- Cl.Cl.COC1=C(OCCCN2CCOCC2)C=CC2=C1N=C(NC(=O)C1=CN=C(N)N=C1)N1CCN=C21
- External Links
- ChemSpider
- 34982929
- ChEBI
- 173081
- ChEMBL
- CHEMBL3545068
- Wikipedia
- Copanlisib
- Predicted Properties
Property Value Source Water Solubility 0.231 mg/mL ALOGPS logP 1.02 ALOGPS logP 0.32 Chemaxon logS -3.3 ALOGPS pKa (Strongest Acidic) 10.15 Chemaxon pKa (Strongest Basic) 6.88 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 11 Chemaxon Hydrogen Donor Count 2 Chemaxon Polar Surface Area 139.79 Å2 Chemaxon Rotatable Bond Count 7 Chemaxon Refractivity 132.78 m3·mol-1 Chemaxon Polarizability 51.63 Å3 Chemaxon Number of Rings 5 Chemaxon Bioavailability 0 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule Yes Chemaxon