![2-[(3-Methylphenyl)methyl]azepane structure](/static/products/3831/383130-52-7.webp)
2-[(3-Methylphenyl)methyl]azepane
TL;DR: 2-[(3-Methylphenyl)methyl]azepane (CAS 383130-52-7) is a chemical compound with molecular formula C14H21N and molecular weight 203.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-methylphenyl)methyl]azepane
Also Known As: 2-(3-methylbenzyl)azepane, 2-[(3-methylphenyl)methyl]azepane, HEXAHYDRO-2-[ METHYL]-1H-AZEPINE, HEXAHYDRO-2-[(3-METHYLPHENYL)METHYL]-1H-AZEPINE, K-8365
| Molecular Formula | C14H21N |
|---|---|
| Molecular Weight | 203.17 g/mol |
| LogP | 3.06972 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 203.1674 |
| Heavy Atoms | 15 |
| Complexity | 297.96194 |
Chemical Identifiers
| CAS Number | 383130-52-7 |
|---|---|
| SMILES | CC1=CC(=CC=C1)CC2CCCCCN2 |
Product Overview
2-[(3-Methylphenyl)methyl]azepane (CAS 383130-52-7), with molecular formula C14H21N and molecular weight 203.17 g/mol. IUPAC: 2-[(3-methylphenyl)methyl]azepane.
Chemical Property Profile of 2-[(3-Methylphenyl)methyl]azepane
Property Insights of 2-[(3-Methylphenyl)methyl]azepane
The XLogP value of 3.06972 indicates that 2-[(3-Methylphenyl)methyl]azepane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.03 Ų, 2-[(3-Methylphenyl)methyl]azepane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(3-Methylphenyl)methyl]azepane has 1 hydrogen bond donor(s) and 1 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 2-[(3-Methylphenyl)methyl]azepane?
The CAS number of 2-[(3-Methylphenyl)methyl]azepane is 383130-52-7.
What is the molecular formula of 2-[(3-Methylphenyl)methyl]azepane?
The molecular formula of 2-[(3-Methylphenyl)methyl]azepane is C14H21N.
What is the molecular weight of 2-[(3-Methylphenyl)methyl]azepane?
The molecular weight of 2-[(3-Methylphenyl)methyl]azepane is 203.17 g/mol.
Where can I buy 2-[(3-Methylphenyl)methyl]azepane?
You can request a quote for 2-[(3-Methylphenyl)methyl]azepane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(3-Methylphenyl)methyl]azepane?
Yes, KEHONG BIO provides custom synthesis services for 2-[(3-Methylphenyl)methyl]azepane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.