Basic information
- Standard SMILES
CCc1nn(-c2cccc(/C=C/c3ccc(Cl)cc3)c2)c(CC)c1C(=O)N1CCC(N(CC)CC)C1- InChIKey
JFWYOILPXILIBE-OUKQBFOZSA-N- Molecular formula
- C30H37ClN4O
- Average molar mass
- 505.1 g/mol
Names & identifiers
- Preferred name
- [Rac]-(1-{3-[(e)-2-(4-chloro-phenyl)-vinyl]-phenyl}-3,5-diethyl-1h-pyrazol-4-yl)-(3-diethylamino-pyrrolidin-1-yl)-methanone
- IUPAC
- [1-[3-[(E)-2-(4-chlorophenyl)ethenyl]phenyl]-3,5-diethylpyrazol-4-yl]-[3-(diethylamino)pyrrolidin-1-yl]methanone
Names & synonyms
SCHEMBL2201133JFWYOILPXILIBE-OUKQBFOZSA-N[rac]-(1-{3-[(e)-2-(4-chloro-phenyl)-vinyl]-phenyl}-3,5-diethyl-1h-pyrazol-4-yl)-(3-diethylamino-pyrrolidin-1-yl)-methanone
Database identifiers
- PubChem CID
- 57555065
Properties
Computed structural properties
- XLogP
- 6.9
- Topological polar surface area
- 41.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 720
Related reactions
1 records
Compound notes
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