Basic information
- CAS
774462-49-6- Standard SMILES
COc1ccc(Nc2ncc3c(C)nc(-c4ccccc4)n3n2)cc1OC- InChIKey
NIAPOVDFZNARJZ-UHFFFAOYSA-N- Molecular formula
- C20H19N5O2
- Average molar mass
- 361.4 g/mol
- Monoisotopic mass
- 361.15387485
Names & identifiers
- Preferred name
- N-[3,4-bis(methyloxy)phenyl]-5-methyl-7-phenylimidazo[5,1-f][1,2,4]triazin-2-amine
- IUPAC
- N-(3,4-dimethoxyphenyl)-5-methyl-7-phenylimidazo[5,1-f][1,2,4]triazin-2-amine
Names & synonyms
CHEMBL521204SCHEMBL3992951NIAPOVDFZNARJZ-UHFFFAOYSA-NDTXSID301139512BDBM50275664N-[3,4-bis(methyloxy)phenyl]-5-methyl-7-phenylimidazo[5,1-f][1,2,4]triazin-2-amine774462-49-6N-(3,4-dimethoxyphenyl)-5-methyl-7-phenylimidazo[1,5-f][1,2,4]triazin-2-amineN-(3,4-dimethoxyphenyl)-5-methyl-7-phenylimidazo[5,1-f][1,2,4]triazin-2-amine
Database identifiers
- CAS
774462-49-6- PubChem CID
- 11405758
- DTXSID
DTXSID301139512- ChEMBL
CHEMBL521204
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 73.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 475
Related reactions
2 records
Compound notes
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