4-Ethyl-5-methyl-1,3,8-triazatricyclo[7.4.0.02,7]trideca-2(7),3,5,8,10,12-hexaene
Basic information
- CAS
421596-03-4- Standard SMILES
CCc1nc2c(cc1C)nc1ccccn12- InChIKey
UDHFJUOFGUFYGN-UHFFFAOYSA-N- Molecular formula
- C13H13N3
- Average molar mass
- 211.26 g/mol
Names & identifiers
- Preferred name
- 4-Ethyl-5-methyl-1,3,8-triazatricyclo[7.4.0.02,7]trideca-2(7),3,5,8,10,12-hexaene
- IUPAC
- 4-ethyl-5-methyl-1,3,8-triazatricyclo[7.4.0.02,7]trideca-2(7),3,5,8,10,12-hexaene
- English name
- Dipyrido[1,2-a:3,2-d]imidazole, 2-ethyl-3-methyl- (9CI)
- Molecular formula
- C13H13N3
- Molecular weight
- 211.26242
Names & synonyms
421596-03-4Dipyrido[1,2-a:3,2-d]imidazole, 2-ethyl-3-methyl- (9CI)
Database identifiers
- CAS
421596-03-4- Nikkaji
- J1.659.049E
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 30.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 256
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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