Basic information
- CAS
5537-69-9- Standard SMILES
Fc1ccc(Nc2nc(N/N=C/c3ccccc3Cl)nc(N3CCCCC3)n2)cc1- InChIKey
UNEMMXMXRGKFRM-ZVHZXABRSA-N- Molecular formula
- C21H21ClFN7
- Average molar mass
- 425.9 g/mol
- Monoisotopic mass
- 425.1530996
Names & identifiers
- Preferred name
- 2-N-[(E)-(2-chlorophenyl)methylideneamino]-4-N-(4-fluorophenyl)-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine
- IUPAC
- 2-N-[(E)-(2-chlorophenyl)methylideneamino]-4-N-(4-fluorophenyl)-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine
Names & synonyms
5537-69-92-N-[(E)-(2-chlorophenyl)methylideneamino]-4-N-(4-fluorophenyl)-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine2-chlorobenzaldehyde [4-[(4-fluorophenyl)amino]-6-(1-piperidinyl)-1,3,5-triazin-2-yl]hydrazoneAC1NSVLZ4-[(2E)-2-[(2-chlorophenyl)methylidene]hydrazin-1-yl]-N-(4-fluorophenyl)-6-(piperidin-1-yl)-1,3,5-triazin-2-amine4-{(2E)-2-[(2-Chlorophenyl)methylidene]hydrazin-1-yl}-N-(4-fluorophenyl)-6-(piperidin-1-yl)-1,3,5-triazin-2-amineDTXSID10416911STL406208AKOS000541973ST507381644-[(2E)-2-(2-chlorobenzylidene)hydrazinyl]-N-(4-fluorophenyl)-6-(piperidin-1-yl)-1,3,5-triazin-2-amine
Database identifiers
- CAS
5537-69-9- PubChem CID
- 5340415
- DTXSID
DTXSID10416911
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 78.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 539
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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