Benzonitrile, 4-((4-amino-6-((3,5-dimethoxyphenyl)methyl)-1,3,5-triazin-2-yl)amino)-
Basic information
- CAS
205381-64-2- Standard SMILES
COc1cc(Cc2nc(N)nc(Nc3ccc(C#N)cc3)n2)cc(OC)c1- InChIKey
ZWWDEZUYVQWDAW-UHFFFAOYSA-N- Molecular formula
- C19H18N6O2
- Average molar mass
- 362.4 g/mol
- Monoisotopic mass
- 362.14912384
Names & identifiers
- Preferred name
- Benzonitrile, 4-((4-amino-6-((3,5-dimethoxyphenyl)methyl)-1,3,5-triazin-2-yl)amino)-
- IUPAC
- 4-[[4-amino-6-[(3,5-dimethoxyphenyl)methyl]-1,3,5-triazin-2-yl]amino]benzonitrile
Names & synonyms
205381-64-2Benzonitrile, 4-((4-amino-6-((3,5-dimethoxyphenyl)methyl)-1,3,5-triazin-2-yl)amino)-4-[[4-amino-6-[(3,5-dimethoxyphenyl)methyl]-1,3,5-triazin-2-yl]amino]benzonitrile4-({4-Amino-6-[(3,5-dimethoxyphenyl)methyl]-1,3,5-triazin-2-yl}amino)benzonitrileBenzonitrile, 4-[[4-amino-6-[(3,5-dimethoxyphenyl)methyl]-1,3,5-triazin-2-yl]amino]-DTXSID60174534
Database identifiers
- CAS
205381-64-2- PubChem CID
- 505437
- DTXSID
DTXSID60174534
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 119 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 492
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…