![1-[1-(3,5-Dimethoxybenzoyl)-4-piperidinyl]azepane structure](/static/products/4320/432017-99-7.webp)
1-[1-(3,5-Dimethoxybenzoyl)-4-piperidinyl]azepane
TL;DR: 1-[1-(3,5-Dimethoxybenzoyl)-4-piperidinyl]azepane (CAS 432017-99-7) is a chemical compound with molecular formula C20H30N2O3 and molecular weight 346.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(azepan-1-yl)piperidin-1-yl]-(3,5-dimethoxyphenyl)methanone
Also Known As: 1-[1-(3,5-dimethoxybenzoyl)-4-piperidinyl]azepane, AT-057/43318946, [4-(azepan-1-yl)piperidin-1-yl]-(3,5-dimethoxyphenyl)methanone, 4-azaperhydroepinylpiperidyl 3,5-dimethoxyphenyl ketone, [4-(1-azepanyl)piperidino](3,5-dimethoxyphenyl)methanone
| Molecular Formula | C20H30N2O3 |
|---|---|
| Molecular Weight | 346.23 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 42.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 346.22565 |
| Heavy Atoms | 25 |
| Complexity | 403.0 |
Chemical Identifiers
| CAS Number | 432017-99-7 |
|---|---|
| SMILES | COC1=CC(=CC(=C1)C(=O)N2CCC(CC2)N3CCCCCC3)OC |
| InChIKey | HVJSBMJCVPLWQM-UHFFFAOYSA-N |
Product Overview
1-[1-(3,5-Dimethoxybenzoyl)-4-piperidinyl]azepane (CAS 432017-99-7), with molecular formula C20H30N2O3 and molecular weight 346.23 g/mol. IUPAC: [4-(azepan-1-yl)piperidin-1-yl]-(3,5-dimethoxyphenyl)methanone.
Chemical Property Profile of 1-[1-(3,5-Dimethoxybenzoyl)-4-piperidinyl]azepane
Property Insights of 1-[1-(3,5-Dimethoxybenzoyl)-4-piperidinyl]azepane
The XLogP value of 3.1 indicates that 1-[1-(3,5-Dimethoxybenzoyl)-4-piperidinyl]azepane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.0 Ų, 1-[1-(3,5-Dimethoxybenzoyl)-4-piperidinyl]azepane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[1-(3,5-Dimethoxybenzoyl)-4-piperidinyl]azepane 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-[1-(3,5-Dimethoxybenzoyl)-4-piperidinyl]azepane?
The CAS number of 1-[1-(3,5-Dimethoxybenzoyl)-4-piperidinyl]azepane is 432017-99-7.
What is the molecular formula of 1-[1-(3,5-Dimethoxybenzoyl)-4-piperidinyl]azepane?
The molecular formula of 1-[1-(3,5-Dimethoxybenzoyl)-4-piperidinyl]azepane is C20H30N2O3.
What is the molecular weight of 1-[1-(3,5-Dimethoxybenzoyl)-4-piperidinyl]azepane?
The molecular weight of 1-[1-(3,5-Dimethoxybenzoyl)-4-piperidinyl]azepane is 346.23 g/mol.
Where can I buy 1-[1-(3,5-Dimethoxybenzoyl)-4-piperidinyl]azepane?
You can request a quote for 1-[1-(3,5-Dimethoxybenzoyl)-4-piperidinyl]azepane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[1-(3,5-Dimethoxybenzoyl)-4-piperidinyl]azepane?
Yes, KEHONG BIO provides custom synthesis services for 1-[1-(3,5-Dimethoxybenzoyl)-4-piperidinyl]azepane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.