Basic information
- Standard SMILES
Cc1sc(NC(=O)c2ccc(N3CCC(c4nncn4C)CC3)nc2)nc1-c1ccccc1- InChIKey
FRMORVSRNBURGQ-UHFFFAOYSA-N- Molecular formula
- C24H25N7OS
- Average molar mass
- 459.6 g/mol
- Monoisotopic mass
- 459.18412962
Names & identifiers
- Preferred name
- 4-(4-methyl-4H-[1,2,4]triazol-3-yl)-3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-5'-carboxylic acid (5-methyl-4-phenyl-thiazol-2-yl)-amide
- IUPAC
- N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)-6-[4-(4-methyl-1,2,4-triazol-3-yl)piperidin-1-yl]pyridine-3-carboxamide
Names & synonyms
SCHEMBL13328336FRMORVSRNBURGQ-UHFFFAOYSA-N4-(4-methyl-4H-[1,2,4]triazol-3-yl)-3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-5'-carboxylic acid (5-methyl-4-phenyl-thiazol-2-yl)-amide
Database identifiers
- PubChem CID
- 59318045
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 117 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 655
Related reactions
1 records
Compound notes
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