Basic information
- Standard SMILES
CCOC(=O)c1nnc(Cl)cc1Nc1cccc(-n2ccnn2)n1- InChIKey
GFVUNAUZFICDAN-UHFFFAOYSA-N- Molecular formula
- C14H12ClN7O2
- Average molar mass
- 345.74 g/mol
- Monoisotopic mass
- 345.0741003
Names & identifiers
- Preferred name
- 6-Chloro-4-(6-[1,2,3]triazol-1-yl-pyridin-2-ylamino)-pyridazine-3-carboxylic acid ethyl ester
- IUPAC
- ethyl 6-chloro-4-[[6-(triazol-1-yl)-2-pyridinyl]amino]pyridazine-3-carboxylate
Names & synonyms
SCHEMBL15091011GFVUNAUZFICDAN-UHFFFAOYSA-N1446791-25-86-chloro-4-(6-[1,2,3]triazol-1-yl-pyridin-2-ylamino)-pyridazine-3-carboxylic acid ethyl esterDB-124299
Database identifiers
- PubChem CID
- 86689708
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 430
Related reactions
2 records
Compound notes
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