3-chloro-N-[[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperidin-4-ylidene]amino]quinoxalin-2-amine
Basic information
- CAS
303148-28-9- Standard SMILES
FC(F)(F)c1cnc(N2CCC(=NNc3nc4ccccc4nc3Cl)CC2)c(Cl)c1- InChIKey
OUJKPSSAGBOEMC-UHFFFAOYSA-N- Molecular formula
- C19H15Cl2F3N6
- Average molar mass
- 455.3 g/mol
Names & identifiers
- Preferred name
- 3-chloro-N-[[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperidin-4-ylidene]amino]quinoxalin-2-amine
- IUPAC
- 3-chloro-N-[[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperidin-4-ylidene]amino]quinoxalin-2-amine
- English name
- 1-[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]tetrahydro-4(1H)-pyridinone N-(3-chloro-2-quinoxalinyl)hydrazone
- Molecular formula
- C19H15Cl2F3N6
- Molecular weight
- 455.26
Names & synonyms
303148-28-93-chloro-N-[[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperidin-4-ylidene]amino]quinoxalin-2-amineAKOS0050780751-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]tetrahydro-4(1H)-pyridinone N-(3-chloro-2-quinoxalinyl)hydrazone11K-9132-chloro-3-(2-{1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperidin-4-ylidene}hydrazin-1-yl)quinoxaline4-Piperidinone, 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-, 2-(3-chloro-2-quinoxalinyl)hydrazone
Database identifiers
- CAS
303148-28-9
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 66.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 3
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 612
Physicochemical properties
- Boiling point
- 558.8 · 558.8±60.0 °C(Predicted)
- Density
- 1.56 · 1.56±0.1 g/cm3(Predicted)
- pka
- 8.62 · 8.62±0.20(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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