IUPAC name
1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(trifluoromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione
SMILES
OC[C@H]1O[C@H](C[C@@H]1O)N1C=C(C(=O)NC1=O)C(F)(F)F
Compound class
Antineoplastic Agents; Antiviral Agents; Antimetabolites; Antineoplastic and Immunomodulating Agents; Ophthalmologicals; Sensory Organs; Antiinfectives; Pyrimidine Analogues;
Therapeutic area
Ophthalmic solution for the treatment of primay keratoconjunctivitis and recurrent epithelial keratitis due to herpes simplex virus, types 1 and 2.
Common name
Trifluridine
IUPAC name
1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(trifluoromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione
SMILES
OC[C@H]1O[C@H](C[C@@H]1O)N1C=C(C(=O)NC1=O)C(F)(F)F
INCHI
InChI=1S/C10H11F3N2O5/c11-10(12,13)4-2-15(9(19)14-8(4)18)7-1-5(17)6(3-16)20-7/h2,5-7,16-17H,1,3H2,(H,14,18,19)/t5-,6+,7+/m0/s1
FORMULA
C10H11F3N2O5
Common name
Trifluridine
IUPAC name
1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(trifluoromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione
Molecular weight
296.200
clogP
0.554
clogS
-0.781
HBond Acceptor
5
HBond Donor
3
Total Polar Surface Area
104.55
Number of Rings
2
Rotatable Bond
3
| Drug ID | Common name | Structure CAS | SMILE | Frequency |
|---|---|---|---|---|
| FDBF00177 | fluoroform |
|
FC(F)F | 0.0704 |
| FDBF00493 | (2R,3S)-2-(hydroxymethyl)tetrahydrofuran-3-ol |
|
C(O)C1OCCC1O | 0.0021 |
| FDBF00494 | (3S)-tetrahydrofuran-3-ol |
|
O1CCC(C1)O | 0.0031 |
| FDBF00949 | (5S)-5-(trifluoromethyl)-5H-pyrimidine-2,4-dione |
|
O=C1N=CC(C(=O)N1)C(F)(F)F | 0.0003 |
| FDBF00950 | 5H-pyrimidine-2,4-dione |
|
O=C1N=CCC(=O)N1 | 0.0017 |
