Basic information
- Standard SMILES
CC(=O)c1ccc(Cn2ncc(NC(=O)c3ncoc3-c3cccc(C)c3)n2)o1- InChIKey
NDBZIXDVDHXDSV-UHFFFAOYSA-N- Molecular formula
- C20H17N5O4
- Average molar mass
- 391.4 g/mol
Names & identifiers
- Preferred name
- 5-m-Tolyl-oxazole-4-carboxylic acid [2-(5-acetyl-furan-2-ylmethyl)-2H-[1,2,3]triazol-4-yl]-amide
- IUPAC
- N-[2-[(5-acetylfuran-2-yl)methyl]triazol-4-yl]-5-(3-methylphenyl)-1,3-oxazole-4-carboxamide
Names & synonyms
SCHEMBL2328926NDBZIXDVDHXDSV-UHFFFAOYSA-N5-m-Tolyl-oxazole-4-carboxylic acid [2-(5-acetyl-furan-2-ylmethyl)-2H-[1,2,3]triazol-4-yl]-amide
Database identifiers
- PubChem CID
- 42646027
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 605
Related reactions
1 records
Compound notes
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