![1-[1-(4-Methoxybenzoyl)-4-piperidinyl]azepane structure](/static/products/4319/431910-69-9.webp)
1-[1-(4-Methoxybenzoyl)-4-piperidinyl]azepane
TL;DR: 1-[1-(4-Methoxybenzoyl)-4-piperidinyl]azepane (CAS 431910-69-9) is a chemical compound with molecular formula C19H28N2O2 and molecular weight 316.22 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]-(4-methoxyphenyl)methanone
Also Known As: 1-[1-(4-methoxybenzoyl)-4-piperidinyl]azepane, [4-(azepan-1-yl)piperidin-1-yl]-(4-methoxyphenyl)methanone, 1-[1-(4-methoxybenzoyl)piperidin-4-yl]azepane, AB01296287-01, 4-azaperhydroepinylpiperidyl 4-methoxyphenyl ketone
| Molecular Formula | C19H28N2O2 |
|---|---|
| Molecular Weight | 316.22 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 32.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 316.2151 |
| Heavy Atoms | 23 |
| Complexity | 364.0 |
Chemical Identifiers
| CAS Number | 431910-69-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)N2CCC(CC2)N3CCCCCC3 |
| InChIKey | SJJGUXCJNPEBAW-UHFFFAOYSA-N |
Product Overview
1-[1-(4-Methoxybenzoyl)-4-piperidinyl]azepane (CAS 431910-69-9), with molecular formula C19H28N2O2 and molecular weight 316.22 g/mol. IUPAC: [4-(azepan-1-yl)piperidin-1-yl]-(4-methoxyphenyl)methanone.
Chemical Property Profile of 1-[1-(4-Methoxybenzoyl)-4-piperidinyl]azepane
Property Insights of 1-[1-(4-Methoxybenzoyl)-4-piperidinyl]azepane
The XLogP value of 3.1 indicates that 1-[1-(4-Methoxybenzoyl)-4-piperidinyl]azepane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.8 Ų, 1-[1-(4-Methoxybenzoyl)-4-piperidinyl]azepane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[1-(4-Methoxybenzoyl)-4-piperidinyl]azepane has 0 hydrogen bond donor(s) and 3 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-(4-Methoxybenzoyl)-4-piperidinyl]azepane?
The CAS number of 1-[1-(4-Methoxybenzoyl)-4-piperidinyl]azepane is 431910-69-9.
What is the molecular formula of 1-[1-(4-Methoxybenzoyl)-4-piperidinyl]azepane?
The molecular formula of 1-[1-(4-Methoxybenzoyl)-4-piperidinyl]azepane is C19H28N2O2.
What is the molecular weight of 1-[1-(4-Methoxybenzoyl)-4-piperidinyl]azepane?
The molecular weight of 1-[1-(4-Methoxybenzoyl)-4-piperidinyl]azepane is 316.22 g/mol.
Where can I buy 1-[1-(4-Methoxybenzoyl)-4-piperidinyl]azepane?
You can request a quote for 1-[1-(4-Methoxybenzoyl)-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-(4-Methoxybenzoyl)-4-piperidinyl]azepane?
Yes, KEHONG BIO provides custom synthesis services for 1-[1-(4-Methoxybenzoyl)-4-piperidinyl]azepane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.