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Azepan-1-yl[1-(4-methoxybenzyl)piperidin-3-yl]methanone structure
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Azepan-1-yl[1-(4-methoxybenzyl)piperidin-3-yl]methanone

TL;DR: Azepan-1-yl[1-(4-methoxybenzyl)piperidin-3-yl]methanone (CAS 524058-53-5) is a chemical compound with molecular formula C20H30N2O2 and molecular weight 330.23074 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

azepan-1-yl-[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]methanone

Also Known As: azepan-1-yl[1-(4-methoxybenzyl)piperidin-3-yl]methanone, AT-057/43319109, azepan-1-yl-[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]methanone, 1-{[1-(4-methoxybenzyl)-3-piperidinyl]carbonyl}azepane, 1-{1-[(4-methoxyphenyl)methyl]piperidine-3-carbonyl}azepane

CAS Number
524058-53-5
Molecular Formula
C20H30N2O2
Molecular Weight
330.23074 g/mol
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Technical Specifications

Molecular FormulaC20H30N2O2
Molecular Weight330.23074 g/mol
XLogP2.9
Topological Polar Surface Area (TPSA)32.8 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors3
Rotatable Bonds4
Exact Mass330.23074 Da
Heavy Atoms24
Complexity385.0
SMILESCOC1=CC=C(C=C1)CN2CCCC(C2)C(=O)N3CCCCCC3
InChIKeyBXUMZSCTKAQEKH-UHFFFAOYSA-N

Chemical Property Profile of Azepan-1-yl[1-(4-methoxybenzyl)piperidin-3-yl]methanone

XLogP
2.9
TPSA (Topological Polar Surface Area)
32.8
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
3
Rotatable Bonds
4
Heavy Atoms
24
Complexity
385.0
Exact Mass
330.23074
Monoisotopic Mass
330.23074
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Azepan-1-yl[1-(4-methoxybenzyl)piperidin-3-yl]methanone

The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Azepan-1-yl[1-(4-methoxybenzyl)piperidin-3-yl]methanone. With a topological polar surface area (TPSA) of 32.8 Ų, Azepan-1-yl[1-(4-methoxybenzyl)piperidin-3-yl]methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Azepan-1-yl[1-(4-methoxybenzyl)piperidin-3-yl]methanone 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

What is the CAS number of Azepan-1-yl[1-(4-methoxybenzyl)piperidin-3-yl]methanone?

The CAS number of Azepan-1-yl[1-(4-methoxybenzyl)piperidin-3-yl]methanone is 524058-53-5.

What is the molecular formula of Azepan-1-yl[1-(4-methoxybenzyl)piperidin-3-yl]methanone?

The molecular formula of Azepan-1-yl[1-(4-methoxybenzyl)piperidin-3-yl]methanone is C20H30N2O2.

What is the molecular weight of Azepan-1-yl[1-(4-methoxybenzyl)piperidin-3-yl]methanone?

The molecular weight of Azepan-1-yl[1-(4-methoxybenzyl)piperidin-3-yl]methanone is 330.23074 g/mol.

Where can I buy Azepan-1-yl[1-(4-methoxybenzyl)piperidin-3-yl]methanone?

You can request a quote for Azepan-1-yl[1-(4-methoxybenzyl)piperidin-3-yl]methanone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Azepan-1-yl[1-(4-methoxybenzyl)piperidin-3-yl]methanone?

Yes, CoreyChem provides custom synthesis services for Azepan-1-yl[1-(4-methoxybenzyl)piperidin-3-yl]methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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