Basic information
- Standard SMILES
COc1c(Cl)cc(F)c(-n2c(=O)cc(C(F)(F)F)n(C)c2=O)c1N- InChIKey
TZOJTTXGUGCIMN-UHFFFAOYSA-N- Molecular formula
- C13H10ClF4N3O3
- Average molar mass
- 367.68 g/mol
Names & identifiers
- Preferred name
- 3-(2-Amino-4-chloro-6fluoro-3-methoxyphenyl)-1-methyl-6-trifluoromethyl-2,4(1H, 3H)pyrimidinedione
- IUPAC
- 3-(2-amino-4-chloro-6-fluoro-3-methoxyphenyl)-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione
Names & synonyms
3-(2-Amino-4-chloro-6fluoro-3-methoxyphenyl)-1-methyl-6-trifluoromethyl-2,4(1H, 3H)pyrimidinedioneSCHEMBL53913013-(2-amino-4-chloro-6-fluoro-3-methoxyphenyl)-1-methyl-6-trifluoromethyl-2,4(1H, 3H)-pyrimidinedione3-(2-amino-4-chloro-6-fluoro-3-methoxyphenyl)-1-methyl-6-trifluoromethyl-2,4(1H, 3H)pyrimidinedione3-(2-Amino-4-chloro-6-fluoro-3-methoxyphenyl)-1-methyl-6trifluoromethyl-2,4(1H, 3H)-pyrimidinedione
Database identifiers
- PubChem CID
- 18314537
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 75.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 2
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 571
Related reactions
25 records
Compound notes
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