Basic information
- Standard SMILES
Cn1c(C(F)(F)F)cc(=O)n(-c2ccc(Cl)c(C3OCCO3)c2)c1=O- InChIKey
QOSCHWAVBYIJPT-UHFFFAOYSA-N- Molecular formula
- C15H12ClF3N2O4
- Average molar mass
- 376.71 g/mol
Names & identifiers
- Preferred name
- 3-(4-Chloro-3-(1,3-dioxolan-2-yl)-phenyl)-2,4-dioxo-1-methyl-6-trifluoromethyl-1,2,3,4-tetrahydropyrimidine
- IUPAC
- 3-[4-chloro-3-(1,3-dioxolan-2-yl)phenyl]-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione
Names & synonyms
3-(4-chloro-3-(1,3-dioxolan-2-yl)-phenyl)-2,4-dioxo-1-methyl-6-trifluoromethyl-1,2,3,4-tetrahydropyrimidineSCHEMBL79278513-(4-chloro-3-(1,3-dioxolan-2-yl)-phenyl)-2,4-dioxo-1-methyl-6-trifluoromethyl-1, 2, 3, 4-tetrahydropyrimidine
Database identifiers
- PubChem CID
- 21201271
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 59.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 592
Related reactions
2 records
Compound notes
Loading…