Basic information
- CAS
112393-72-3- Standard SMILES
Cc1nnc(-c2ccccc2)nc1C(N)=O- InChIKey
BBVTVHLEKYBLED-UHFFFAOYSA-N- Molecular formula
- C11H10N4O
- Average molar mass
- 214.22 g/mol
- Monoisotopic mass
- 214.08546096
Names & identifiers
- Preferred name
- 6-Methyl-3-phenyl-1,2,4-triazine-5-carboxamide
- IUPAC
- 6-methyl-3-phenyl-1,2,4-triazine-5-carboxamide
Names & synonyms
112393-72-36-Methyl-3-phenyl-1,2,4-triazine-5-carboxamideDTXSID10549157
Database identifiers
- CAS
112393-72-3- PubChem CID
- 13778357
- DTXSID
DTXSID10549157
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 81.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 252
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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