Basic information
- Standard SMILES
CCOC(=O)Cc1nnc(-c2ccccc2)c(-c2ccccc2)n1- InChIKey
AZCOCUCYBNKFAB-UHFFFAOYSA-N- Molecular formula
- C19H17N3O2
- Average molar mass
- 319.4 g/mol
Names & identifiers
- Preferred name
- Ethyl 2-(5,6-Diphenyl-1,2,4-triazin-3-yl)acetate
- IUPAC
- ethyl 2-(5,6-diphenyl-1,2,4-triazin-3-yl)acetate
Names & synonyms
Ethyl 2-(5,6-Diphenyl-1,2,4-triazin-3-yl)acetateSCHEMBL2832164AZCOCUCYBNKFAB-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 12915487
- Nikkaji
- J510.439D
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 65 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 392
Related reactions
1 records
Compound notes
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