Dimethyl-(4-pyrido(3,4-e)(1,2,4)triazin-3-yl-phenyl)-amine
Basic information
- CAS
121845-62-3- Standard SMILES
CN(C)c1ccc(-c2nnc3ccncc3n2)cc1- InChIKey
VMCOUAAPOBDSCN-UHFFFAOYSA-N- Molecular formula
- C14H13N5
- Average molar mass
- 251.29 g/mol
- Monoisotopic mass
- 251.11709544
Names & identifiers
- Preferred name
- Dimethyl-(4-pyrido(3,4-e)(1,2,4)triazin-3-yl-phenyl)-amine
- IUPAC
- N,N-dimethyl-4-pyrido[3,4-e][1,2,4]triazin-3-ylaniline
Names & synonyms
121845-62-3N,N-Dimethyl-4-(pyrido[3,4-e][1,2,4]triazin-3-yl)anilineDimethyl-(4-pyrido(3,4-e)(1,2,4)triazin-3-yl-phenyl)-amineDimethyl-(4-pyrido[3,4-e][1,2,4]triazin-3-yl-phenyl)-amineCHEMBL309210DTXSID10153399N,N-dimethyl-4-pyrido[3,4-e][1,2,4]triazin-3-yl-aniline
Database identifiers
- CAS
121845-62-3- PubChem CID
- 516611
- DTXSID
DTXSID10153399- ChEMBL
CHEMBL309210- Nikkaji
- J239.920B
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 54.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 288
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Compound notes
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