Basic information
- Standard SMILES
CCOC(=O)Cc1cn(Cc2ccc(OCc3nc(-c4ccccc4)oc3C)cc2)nc1OCC- InChIKey
KLCVCMAXORPMMJ-UHFFFAOYSA-N- Molecular formula
- C27H29N3O5
- Average molar mass
- 475.5 g/mol
Names & identifiers
- Preferred name
- ethyl 3-ethoxy-1-[4-(5-methyl-2-phenyl-4-oxazolylmethoxy)benzyl]-1H-pyrazol-4-ylacetate
- IUPAC
- ethyl 2-[3-ethoxy-1-[[4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]methyl]pyrazol-4-yl]acetate
Names & synonyms
SCHEMBL5382729KLCVCMAXORPMMJ-UHFFFAOYSA-Nethyl 3-ethoxy-1-[4-(5-methyl-2-phenyl-4-oxazolylmethoxy)benzyl]-1H-pyrazol-4-ylacetate
Database identifiers
- PubChem CID
- 69423265
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 88.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 12
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 638
Related reactions
4 records
Compound notes
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