Basic information
- Standard SMILES
CCOC(=O)Cc1ccc(NC(=O)CCc2cnn(-c3ccccc3)c2-c2ccccc2)cc1- InChIKey
RJKADPSCPMSTRE-UHFFFAOYSA-N- Molecular formula
- C28H27N3O3
- Average molar mass
- 453.5 g/mol
Names & identifiers
- Preferred name
- N-[4-(ethoxycarbonylmethyl)phenyl]-3-(1,5-diphenyl-1H-pyrazol-4-yl)propionamide
- IUPAC
- ethyl 2-[4-[3-(1,5-diphenylpyrazol-4-yl)propanoylamino]phenyl]acetate
Names & synonyms
SCHEMBL4831316RJKADPSCPMSTRE-UHFFFAOYSA-NN-[4-(ethoxycarbonylmethyl)phenyl]-3-(1,5-diphenyl-1H-pyrazol-4-yl)propionamide
Database identifiers
- PubChem CID
- 69207828
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 73.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 637
Related reactions
2 records
Compound notes
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