Basic information
- CAS
54246-86-5- Standard SMILES
COc1ccc2c(c1)CCC1=C2N=CN2CCN=C12- InChIKey
XUDNNBPQMNRVTE-UHFFFAOYSA-N- Molecular formula
- C15H15N3O
- Average molar mass
- 253.3 g/mol
- Monoisotopic mass
- 253.12151211
Names & identifiers
- Preferred name
- 5-Methoxy-12,15,17-triazatetracyclo[8.7.0.02,7.011,15]heptadeca-1(10),2(7),3,5,11,16-hexaene
- IUPAC
- 5-methoxy-12,15,17-triazatetracyclo[8.7.0.02,7.011,15]heptadeca-1(10),2(7),3,5,11,16-hexaene
Names & synonyms
NSC30549954246-86-5DTXSID40316657NSC-3054997-Methoxy-1,2,4,5-tetrahydrobenzo[h]imidazo[1,2-c]quinazoline
Database identifiers
- CAS
54246-86-5- PubChem CID
- 328064
- DTXSID
DTXSID40316657
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 37.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 480
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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