Basic information
- CAS
52713-18-5- Standard SMILES
Clc1ccc(-n2cnn3c(-c4ccccc4)ncc23)cc1- InChIKey
WUPIZZVMZCPNKQ-UHFFFAOYSA-N- Molecular formula
- C16H11ClN4
- Average molar mass
- 294.74 g/mol
- Monoisotopic mass
- 294.0672241
Names & identifiers
- Preferred name
- 1-(4-Chlorophenyl)-5-phenyl-1H-imidazo(1,5-b)(1,2,4)triazole
- IUPAC
- 1-(4-chlorophenyl)-5-phenylimidazo[1,5-b][1,2,4]triazole
Names & synonyms
52713-18-51-(4-Chlorophenyl)-5-phenyl-1H-imidazo(1,5-b)(1,2,4)triazoleNSC295284NSC 2952841-(4-Chlorophenyl)-5-phenyl-1H-imidazo[1,5-b][1,2,4]triazoleDTXSID40200683NSC-2952841-(4-chlorophenyl)-5-phenyl-imidazo[1,5-b][1,2,4]triazole
Database identifiers
- CAS
52713-18-5- PubChem CID
- 325809
- DTXSID
DTXSID40200683
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 35.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 352
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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