Cidofovir dihydrateProduct ingredient for Cidofovir
- Name
- Cidofovir dihydrate
- Drug Entry
- Cidofovir
Cidofovir is an injectable antiviral medication employed in the treatment of cytomegalovirus (CMV) retinitis in patients diagnosed with AIDS. It suppresses CMV replication through selective inhibition of viral DNA synthesis.Label It was manufactured by Gilead and initially approved by the FDA in 1996, but has since been discontinued.1
- Accession Number
- DBSALT001827
- Structure
Structure for Cidofovir dihydrate (DBSALT001827)
- Synonyms
- (((S)-2-(4-amino-2-oxo-1(2H)-pyrimidinyl)-1-(hydroxymethyl)ethoxy)methyl)phosphonic acid, dihydrate / ({[(2S)-1-(4-amino-2-oxopyrimidin-1(2H)-yl)-3-hydroxypropan-2-yl]oxy}methyl)phosphonic acid dihydrate / 1-((S)-3-hydroxy-2-(phosphonomethoxy)propyl)cytosine dihydrate / Cidofovir hydrate
- UNII
- JIL713Q00N
- CAS Number
- 149394-66-1
- Weight
- Average: 315.219
Monoisotopic: 315.08315155 - Chemical Formula
- C8H18N3O8P
- InChI Key
- FPKARFMSZDBYQF-ILKKLZGPSA-N
- InChI
- InChI=1S/C8H14N3O6P.2H2O/c9-7-1-2-11(8(13)10-7)3-6(4-12)17-5-18(14,15)16;;/h1-2,6,12H,3-5H2,(H2,9,10,13)(H2,14,15,16);2*1H2/t6-;;/m0../s1
- IUPAC Name
- ({[(2S)-1-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3-hydroxypropan-2-yl]oxy}methyl)phosphonic acid dihydrate
- SMILES
- O.O.NC1=NC(=O)N(C[C@@H](CO)OCP(O)(O)=O)C=C1
- External Links
- Predicted Properties
Property Value Source Water Solubility 11.5 mg/mL ALOGPS logP -2.1 ALOGPS logP -3 Chemaxon logS -1.4 ALOGPS pKa (Strongest Acidic) 1.05 Chemaxon pKa (Strongest Basic) 1.76 Chemaxon Physiological Charge -1 Chemaxon Hydrogen Acceptor Count 8 Chemaxon Hydrogen Donor Count 4 Chemaxon Polar Surface Area 145.68 Å2 Chemaxon Rotatable Bond Count 6 Chemaxon Refractivity 60.43 m3·mol-1 Chemaxon Polarizability 24.4 Å3 Chemaxon Number of Rings 1 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon