Olanzapine pamoateProduct ingredient for Olanzapine
- Name
- Olanzapine pamoate
- Drug Entry
- Olanzapine
Olanzapine is a thienobenzodiazepine classified as an atypical or second-generation antipsychotic agent.2 The second-generation antipsychotics were introduced in the 90s and quickly gained traction due to their impressive efficacy, reduced risk for extrapyramidal side effects and reduced susceptibility to drug-drug interactions.5 Olanzapine very closely resembles clozapine and only differs by two additional methyl groups and the absence of a chloride moiety.10 It was discovered by scientists at Eli Lilly and approved to be marketed in the US in 1996.8
- Accession Number
- DBSALT001064
- Structure
Structure for Olanzapine pamoate (DBSALT001064)
- Synonyms
- Not Available
- UNII
- X7S6Q4MHCB
- CAS Number
- 221373-18-8
- Weight
- Average: 718.83
Monoisotopic: 718.246120754 - Chemical Formula
- C40H38N4O7S
- InChI Key
- ZIMCQJVMPKQQPB-UHFFFAOYSA-N
- InChI
- InChI=1S/C23H16O6.C17H20N4S.H2O/c24-20-16(14-7-3-1-5-12(14)9-18(20)22(26)27)11-17-15-8-4-2-6-13(15)10-19(21(17)25)23(28)29;1-12-11-13-16(21-9-7-20(2)8-10-21)18-14-5-3-4-6-15(14)19-17(13)22-12;/h1-10,24-25H,11H2,(H,26,27)(H,28,29);3-6,11,19H,7-10H2,1-2H3;1H2
- IUPAC Name
- 4-[(3-carboxy-2-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylic acid 5-methyl-8-(4-methylpiperazin-1-yl)-4-thia-2,9-diazatricyclo[8.4.0.0^{3,7}]tetradeca-1(14),3(7),5,8,10,12-hexaene hydrate
- SMILES
- O.CN1CCN(CC1)C1=NC2=CC=CC=C2NC2=C1C=C(C)S2.OC(=O)C1=CC2=CC=CC=C2C(CC2=C(O)C(=CC3=CC=CC=C23)C(O)=O)=C1O
- External Links
- ChemSpider
- 13212201
- ChEMBL
- CHEMBL3989694
- Wikipedia
- Olanzapine
- Predicted Properties
Property Value Source Water Solubility 0.00418 mg/mL ALOGPS logP 4.58 ALOGPS logP 6.05 Chemaxon logS -5 ALOGPS pKa (Strongest Acidic) 2.38 Chemaxon pKa (Strongest Basic) -6.3 Chemaxon Physiological Charge -2 Chemaxon Hydrogen Acceptor Count 6 Chemaxon Hydrogen Donor Count 4 Chemaxon Polar Surface Area 115.06 Å2 Chemaxon Rotatable Bond Count 4 Chemaxon Refractivity 107.17 m3·mol-1 Chemaxon Polarizability 38.88 Å3 Chemaxon Number of Rings 8 Chemaxon Bioavailability 0 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon