Basic information
- Standard SMILES
CCOC(=O)c1nc2cc(NC(=O)c3c(C(=O)N4CCC4)cnn3C)ccn2n1- InChIKey
BGZCUKRAAMLYCS-UHFFFAOYSA-N- Molecular formula
- C18H19N7O4
- Average molar mass
- 397.4 g/mol
- Monoisotopic mass
- 397.14985211
Names & identifiers
- Preferred name
- 7-{[4-(azetidine-1-carbonyl)-2-methyl-2H-pyrazole-3-carbonyl]-amino}-[1,2,4]triazolo[1,5-a]pyridine-2-carboxylic acid ethyl ester
- IUPAC
- ethyl 7-[[4-(azetidine-1-carbonyl)-1-methylpyrazole-5-carbonyl]amino]-[1,2,4]triazolo[1,5-a]pyridine-2-carboxylate
Names & synonyms
SCHEMBL9106746BGZCUKRAAMLYCS-UHFFFAOYSA-N7-{[4-(azetidine-1-carbonyl)-2-methyl-2H-pyrazole-3-carbonyl]-amino}-[1,2,4]triazolo[1,5-a]pyridine-2-carboxylic acid ethyl ester
Database identifiers
- PubChem CID
- 67775245
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 124 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 658
Related reactions
4 records
Compound notes
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