Basic information
- Standard SMILES
O[C@]1(CF)[C@H](OCc2ccc(Cl)cc2Cl)[C@@H](COCc2ccc(Cl)cc2Cl)O[C@H]1n1ccc2c(Cl)ncnc21- InChIKey
SOVMIXFUJFDHOG-SAZLYLDSSA-N- Molecular formula
- C26H21Cl5FN3O4
- Average molar mass
- 635.7 g/mol
Names & identifiers
- Preferred name
- 4-Chloro-7-[3,5-bis-o-(2,4-dichlorophenylmethyl)-2-c-fluoromethyl-beta-d-ribofuranosyl]-7h-pyrrolo[2,3-d]pyrimidine
- IUPAC
- (2R,3R,4R,5R)-2-(4-chloropyrrolo[2,3-d]pyrimidin-7-yl)-4-[(2,4-dichlorophenyl)methoxy]-5-[(2,4-dichlorophenyl)methoxymethyl]-3-(fluoromethyl)oxolan-3-ol
Names & synonyms
SCHEMBL1738571SOVMIXFUJFDHOG-SAZLYLDSSA-N4-chloro-7-[3,5-bis-o-(2,4-dichlorophenylmethyl)-2-c-fluoromethyl-beta-d-ribofuranosyl]-7h-pyrrolo[2,3-d]pyrimidine4-chloro-7-[3,5-bis-o-(2.4-dichlorophenylmethyl)-2-c-fluoromethyl-beta-d-ribofuranosyl]-7h-pyrrolo[2,3-d]pyrimidine
Database identifiers
- PubChem CID
- 87285368
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 78.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 813
Related reactions
12 records
Compound notes
Loading…