1-(3-Cyclohexen-1-ylmethyl)-4-(2,3-dimethoxybenzoyl)piperazine
TL;DR: 1-(3-Cyclohexen-1-ylmethyl)-4-(2,3-dimethoxybenzoyl)piperazine (CAS 523997-95-7) is a chemical compound with molecular formula C20H28N2O3 and molecular weight 344.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(cyclohex-3-en-1-ylmethyl)piperazin-1-yl]-(2,3-dimethoxyphenyl)methanone
Also Known As: AT-057/43318742, 1-(3-cyclohexen-1-ylmethyl)-4-(2,3-dimethoxybenzoyl)piperazine, [4-(cyclohex-3-en-1-ylmethyl)piperazin-1-yl]-(2,3-dimethoxyphenyl)methanone, [4-(cyclohex-3-en-1-ylmethyl)piperazin-1-yl](2,3-dimethoxyphenyl)methanone, 1-(cyclohex-3-en-1-ylmethyl)-4-(2,3-dimethoxybenzoyl)piperazine
| Molecular Formula | C20H28N2O3 |
|---|---|
| Molecular Weight | 344.21 g/mol |
| LogP | 2.8179 |
| Topological Polar Surface Area | 42.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 344.21 |
| Heavy Atoms | 25 |
| Complexity | 621.3673 |
Chemical Identifiers
| CAS Number | 523997-95-7 |
|---|---|
| SMILES | COC1=CC=CC(=C1OC)C(=O)N2CCN(CC2)CC3CCC=CC3 |
Product Overview
1-(3-Cyclohexen-1-ylmethyl)-4-(2,3-dimethoxybenzoyl)piperazine (CAS 523997-95-7), with molecular formula C20H28N2O3 and molecular weight 344.21 g/mol. IUPAC: [4-(cyclohex-3-en-1-ylmethyl)piperazin-1-yl]-(2,3-dimethoxyphenyl)methanone.
Chemical Property Profile of 1-(3-Cyclohexen-1-ylmethyl)-4-(2,3-dimethoxybenzoyl)piperazine
Property Insights of 1-(3-Cyclohexen-1-ylmethyl)-4-(2,3-dimethoxybenzoyl)piperazine
The XLogP value of 2.8179 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Cyclohexen-1-ylmethyl)-4-(2,3-dimethoxybenzoyl)piperazine. With a topological polar surface area (TPSA) of 42.01 Ų, 1-(3-Cyclohexen-1-ylmethyl)-4-(2,3-dimethoxybenzoyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Cyclohexen-1-ylmethyl)-4-(2,3-dimethoxybenzoyl)piperazine has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(3-Cyclohexen-1-ylmethyl)-4-(2,3-dimethoxybenzoyl)piperazine?
The CAS number of 1-(3-Cyclohexen-1-ylmethyl)-4-(2,3-dimethoxybenzoyl)piperazine is 523997-95-7.
What is the molecular formula of 1-(3-Cyclohexen-1-ylmethyl)-4-(2,3-dimethoxybenzoyl)piperazine?
The molecular formula of 1-(3-Cyclohexen-1-ylmethyl)-4-(2,3-dimethoxybenzoyl)piperazine is C20H28N2O3.
What is the molecular weight of 1-(3-Cyclohexen-1-ylmethyl)-4-(2,3-dimethoxybenzoyl)piperazine?
The molecular weight of 1-(3-Cyclohexen-1-ylmethyl)-4-(2,3-dimethoxybenzoyl)piperazine is 344.21 g/mol.
Where can I buy 1-(3-Cyclohexen-1-ylmethyl)-4-(2,3-dimethoxybenzoyl)piperazine?
You can request a quote for 1-(3-Cyclohexen-1-ylmethyl)-4-(2,3-dimethoxybenzoyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Cyclohexen-1-ylmethyl)-4-(2,3-dimethoxybenzoyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Cyclohexen-1-ylmethyl)-4-(2,3-dimethoxybenzoyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.