Basic information
- Standard SMILES
COc1ccc(Cn2cc(-c3cccc(CO)c3)c(C(=O)Nc3ccccc3)n2)cc1- InChIKey
AQXSYCRXWOJANK-UHFFFAOYSA-N- Molecular formula
- C25H23N3O3
- Average molar mass
- 413.5 g/mol
Names & identifiers
- Preferred name
- 1h-Pyrazole-3-carboxamide,4-[3-(hydroxymethyl)phenyl]-1-[(4-methoxyphenyl)methyl]-n-phenyl-
- IUPAC
- 4-[3-(hydroxymethyl)phenyl]-1-[(4-methoxyphenyl)methyl]-N-phenylpyrazole-3-carboxamide
Names & synonyms
1h-pyrazole-3-carboxamide,4-[3-(hydroxymethyl)phenyl]-1-[(4-methoxyphenyl)methyl]-n-phenyl-844443-89-6SCHEMBL953675AQXSYCRXWOJANK-UHFFFAOYSA-N4-(3-hydroxymethyl-phenyl)-1-(4-methoxy-benzyl)-1H-pyrazole-3-carboxylic acid phenylamide
Database identifiers
- PubChem CID
- 66855422
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 76.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 560
Related reactions
16 records
Compound notes
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