4-chloro-3H-triazolo[4,5-g]quinoline
Basic information
- CAS
261764-98-1- Standard SMILES
Clc1c2ncccc2cc2n[nH]nc12- InChIKey
LUZPZOHDHGKEEU-UHFFFAOYSA-N- Molecular formula
- C9H5ClN4
- Average molar mass
- 204.61 g/mol
- Monoisotopic mass
- 204.0202739
Names & identifiers
- Preferred name
- 4-chloro-3H-triazolo[4,5-g]quinoline
- IUPAC
- 4-chloro-2H-triazolo[4,5-g]quinoline
Names & synonyms
NSC690029261764-98-14-chloro-3H-triazolo[4,5-g]quinoline4-Chloro-3H-[1,2,3]triazolo[4,5-g]quinolineCHEMBL1940437DTXSID60327821NSC-690029NCI60_0323594-Chloro-2H-[1,2,3]triazolo[4,5-g]quinoline
Database identifiers
- CAS
261764-98-1- PubChem CID
- 391196
- DTXSID
DTXSID60327821- ChEMBL
CHEMBL1940437- Nikkaji
- J1.245.944K
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 54.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 225
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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