Basic information
- Standard SMILES
COc1cc(CN2CCN(C(=O)c3cc4ccccc4oc3=O)CC2)cc(OC)c1OC- InChIKey
VIPHGIHSGPNMGY-UHFFFAOYSA-N- Molecular formula
- C24H26N2O6
- Average molar mass
- 438.5 g/mol
Names & identifiers
- Preferred name
- 1-(3-Coumarinylcarbonyl)-4-(3,4,5-trimethoxybenzyl)piperazine
- IUPAC
- 3-[4-[(3,4,5-trimethoxyphenyl)methyl]piperazine-1-carbonyl]chromen-2-one
Names & synonyms
SCHEMBL10334852VIPHGIHSGPNMGY-UHFFFAOYSA-N1-(3-coumarinylcarbonyl)-4-(3,4,5-trimethoxybenzyl)piperazine
Database identifiers
- PubChem CID
- 14849702
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 77.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 691
Related reactions
2 records
Compound notes
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