Basic information
- Standard SMILES
Cc1nc(-n2ccc(OCc3cscn3)cc2=O)sc1C(=O)NCc1ccccc1- InChIKey
FYZZFGYHRGTQFW-UHFFFAOYSA-N- Molecular formula
- C21H18N4O3S2
- Average molar mass
- 438.5 g/mol
- Monoisotopic mass
- 438.0820328
Names & identifiers
- Preferred name
- N-Benzyl-4-methyl-2-(2-oxo-4-(thiazol-4-ylmethoxy)pyridin-1(2H)-yl)thiazole-5-carboxamide
- IUPAC
- N-benzyl-4-methyl-2-[2-oxo-4-(1,3-thiazol-4-ylmethoxy)-1-pyridinyl]-1,3-thiazole-5-carboxamide
Names & synonyms
CHEMBL3104394SCHEMBL3369637FYZZFGYHRGTQFW-UHFFFAOYSA-NBDBM50445725N-Benzyl-4-methyl-2-(2-oxo-4-(thiazol-4-ylmethoxy)pyridin-1(2H) yl)thiazole-5 carboxamideN-Benzyl-4-methyl-2-(2-oxo-4-(thiazol-4-ylmethoxy)pyridin-1(2H)-yl)thiazole-5-carboxamide
Database identifiers
- PubChem CID
- 57744455
- ChEMBL
CHEMBL3104394
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 141 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 696
Related reactions
2 records
Compound notes
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