Basic information
- CAS
3995-45-7- Standard SMILES
CCN(c1ccccc1)c1nc(Cl)nc(N(CC)c2ccccc2)n1- InChIKey
JTOAJBPFKFVVAP-UHFFFAOYSA-N- Molecular formula
- C19H20ClN5
- Average molar mass
- 353.8 g/mol
- Monoisotopic mass
- 353.1407234
Names & identifiers
- Preferred name
- 6-chloro-2-N,4-N-diethyl-2-N,4-N-diphenyl-1,3,5-triazine-2,4-diamine
- IUPAC
- 6-chloro-2-N,4-N-diethyl-2-N,4-N-diphenyl-1,3,5-triazine-2,4-diamine
Names & synonyms
3995-45-7NSC99846DTXSID70960465NSC-99846F3409-19286-CHLORO-N2,N4-DIETHYL-N2,N4-DIPHENYL-1,3,5-TRIAZINE-2,4-DIAMINE6-Chloro-N~2~,N~4~-diethyl-N~2~,N~4~-diphenyl-1,3,5-triazine-2,4-diamine
Database identifiers
- CAS
3995-45-7- PubChem CID
- 264665
- DTXSID
DTXSID70960465
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 45.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 350
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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