Basic information
- Standard SMILES
CCN(CC)C1CCN(C(=O)c2nn(C)c(-c3cccc(-c4ccccc4)c3)c2C)C1- InChIKey
QYNLPUQJOQKTMM-UHFFFAOYSA-N- Molecular formula
- C26H32N4O
- Average molar mass
- 416.6 g/mol
Names & identifiers
- Preferred name
- (5-biphenyl-3-yl-1,4-dimethyl-1H-pyrazol-3-yl)-(3-diethylamino-pyrrolidin-1-yl)-methanone
- IUPAC
- [3-(diethylamino)pyrrolidin-1-yl]-[1,4-dimethyl-5-(3-phenylphenyl)pyrazol-3-yl]methanone
Names & synonyms
SCHEMBL2201649QYNLPUQJOQKTMM-UHFFFAOYSA-N(5-biphenyl-3-yl-1,4-dimethyl-1H-pyrazol-3-yl)-(3-diethylamino-pyrrolidin-1-yl)-methanone
Database identifiers
- PubChem CID
- 57555009
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 41.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 588
Related reactions
2 records
Compound notes
Loading…