Amsacrine gluconateProduct ingredient for Amsacrine
- Name
- Amsacrine gluconate
- Drug Entry
- Amsacrine
Aminoacridine derivative that is a potent intercalating antineoplastic agent. It is effective in the treatment of acute leukemias and malignant lymphomas, but has poor activity in the treatment of solid tumors. It is frequently used in combination with other antineoplastic agents in chemotherapy protocols. It produces consistent but acceptable myelosuppression and cardiotoxic effects.
- Accession Number
- DBSALT002301
- Structure
Structure for Amsacrine gluconate (DBSALT002301)
- Synonyms
- Not Available
- UNII
- M4P91439UZ
- CAS Number
- 80277-07-2
- Weight
- Average: 589.62
Monoisotopic: 589.173015384 - Chemical Formula
- C27H31N3O10S
- InChI Key
- XXNAQBNJPZNRSZ-IFWQJVLJSA-N
- InChI
- InChI=1S/C21H19N3O3S.C6H12O7/c1-27-20-13-14(24-28(2,25)26)11-12-19(20)23-21-15-7-3-5-9-17(15)22-18-10-6-4-8-16(18)21;7-1-2(8)3(9)4(10)5(11)6(12)13/h3-13,24H,1-2H3,(H,22,23);2-5,7-11H,1H2,(H,12,13)/t;2-,3-,4+,5-/m.1/s1
- IUPAC Name
- (2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid; N-{4-[(acridin-9-yl)amino]-3-methoxyphenyl}methanesulfonamide
- SMILES
- OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C(O)=O.COC1=CC(NS(C)(=O)=O)=CC=C1NC1=C2C=CC=CC2=NC2=CC=CC=C12
- External Links
- ChemSpider
- 18543597
- Predicted Properties
Property Value Source Water Solubility 0.00317 mg/mL ALOGPS logP 4.66 ALOGPS logP 3.16 Chemaxon logS -5.1 ALOGPS pKa (Strongest Acidic) 10.82 Chemaxon pKa (Strongest Basic) 8.44 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 5 Chemaxon Hydrogen Donor Count 2 Chemaxon Polar Surface Area 80.32 Å2 Chemaxon Rotatable Bond Count 9 Chemaxon Refractivity 107.69 m3·mol-1 Chemaxon Polarizability 41.67 Å3 Chemaxon Number of Rings 4 Chemaxon Bioavailability 1 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule Yes Chemaxon