Basic information
- Standard SMILES
CC(C)Oc1cc(-n2ncc(=O)n(CCF)c2=O)c(Cl)cc1Cl- InChIKey
LRYFBHOYIBWWKG-UHFFFAOYSA-N- Molecular formula
- C14H14Cl2FN3O3
- Average molar mass
- 362.2 g/mol
Names & identifiers
- Preferred name
- 2-[2,4-dichloro-5-(1-methylethoxy)phenyl]-4-(2-fluoroethyl)-1,2,4-triazine-3,5(2H,4H)-dione
- IUPAC
- 2-(2,4-dichloro-5-propan-2-yloxyphenyl)-4-(2-fluoroethyl)-1,2,4-triazine-3,5-dione
Names & synonyms
SCHEMBL10460663LRYFBHOYIBWWKG-UHFFFAOYSA-N2-[2,4-dichloro-5-(1-methylethoxy)phenyl]-4-(2-fluoroethyl)-1,2,4-triazine-3,5(2H,4H)-dione
Database identifiers
- PubChem CID
- 14747832
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 62.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 492
Related reactions
3 records
Compound notes
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