Omigapil maleateProduct ingredient for Omigapil
- Name
- Omigapil maleate
- Drug Entry
- Omigapil
Omigapil has been used in trials studying the treatment of Congenital Muscular Dystrophy.
- Accession Number
- DBSALT002340
- Structure
Structure for Omigapil maleate (DBSALT002340)
- Synonyms
- Not Available
- UNII
- 3Q69BFZ4OP
- CAS Number
- 200189-97-5
- Weight
- Average: 391.423
Monoisotopic: 391.14197278 - Chemical Formula
- C23H21NO5
- InChI Key
- SQAZQLMBEHYFJA-BTJKTKAUSA-N
- InChI
- InChI=1S/C19H17NO.C4H4O4/c1-3-12-20(2)14-16-13-15-8-4-6-10-18(15)21-19-11-7-5-9-17(16)19;5-3(6)1-2-4(7)8/h1,4-11,13H,12,14H2,2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-
- IUPAC Name
- (2Z)-but-2-enedioic acid; methyl({2-oxatricyclo[9.4.0.0^{3,8}]pentadeca-1(15),3(8),4,6,9,11,13-heptaen-9-yl}methyl)(prop-2-yn-1-yl)amine
- SMILES
- OC(=O)\C=C/C(O)=O.CN(CC#C)CC1=CC2=CC=CC=C2OC2=C1C=CC=C2
- External Links
- ChemSpider
- 7997570
- Predicted Properties
Property Value Source Water Solubility 0.0122 mg/mL ALOGPS logP 3.85 ALOGPS logP 3.8 Chemaxon logS -4.4 ALOGPS pKa (Strongest Basic) 7.31 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 1 Chemaxon Hydrogen Donor Count 0 Chemaxon Polar Surface Area 12.47 Å2 Chemaxon Rotatable Bond Count 5 Chemaxon Refractivity 87.06 m3·mol-1 Chemaxon Polarizability 31 Å3 Chemaxon Number of Rings 3 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule Yes Chemaxon MDDR-like Rule No Chemaxon