Basic information
- Standard SMILES
COc1ccc(OC(=O)CN2CCN(Cc3cc(OC)c(OC)c(OC)c3)CC2)cc1- InChIKey
RVYZAZTXLLAVGZ-UHFFFAOYSA-N- Molecular formula
- C23H30N2O6
- Average molar mass
- 430.5 g/mol
- Monoisotopic mass
- 430.21038668
Names & identifiers
- Preferred name
- KB-5492 free base
- IUPAC
- (4-methoxyphenyl) 2-[4-[(3,4,5-trimethoxyphenyl)methyl]piperazin-1-yl]acetate
Names & synonyms
KB-5492 free baseKB-5492 (free base)113594-64-24-Methoxyphenyl 2-(4-(3,4,5-trimethoxybenzyl)piperazin-1-yl)acetate(4-methoxyphenyl) 2-[4-[(3,4,5-trimethoxyphenyl)methyl]piperazin-1-yl]acetateorb1687648SCHEMBL10350361RVYZAZTXLLAVGZ-UHFFFAOYSA-NEX-A11331HY-47228MS-27653CS-0530142
Show more names
H42850T623961-[(4-methoxyphenoxy)carbonylmethyl]-4-(3,4,5-trimethoxybenzyl)piperazine
Database identifiers
- PubChem CID
- 131083
- Nikkaji
- J458.733B
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 69.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 10
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 520
Related reactions
3 records
Compound notes
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