7-(4-Chlorophenyl)-2-methyloxazepane
TL;DR: 7-(4-Chlorophenyl)-2-methyloxazepane (CAS 3358-91-6) is a chemical compound with molecular formula C12H16ClNO and molecular weight 225.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(4-chlorophenyl)-2-methyloxazepane
Also Known As: 7-(4-chlorophenyl)-2-methyloxazepane, 7-(4-Chlorophenyl)-2-methyl-1,2-oxazepane, 7- hexahydro-2-methyl-1,2-oxazepine, 1,2-Oxazepine, 7-(p-chlorophenyl)hexahydro-2-methyl-, 7-(4-chloro-phenyl)-2-methyl-[1,2]oxazepane
| Molecular Formula | C12H16ClNO |
|---|---|
| Molecular Weight | 225.09 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 225.09204 |
| Heavy Atoms | 15 |
| Complexity | 192.0 |
Chemical Identifiers
| CAS Number | 3358-91-6 |
|---|---|
| SMILES | CN1CCCCC(O1)C2=CC=C(C=C2)Cl |
| InChIKey | OHUSWGXRTZCANN-UHFFFAOYSA-N |
Product Overview
7-(4-Chlorophenyl)-2-methyloxazepane (CAS 3358-91-6), with molecular formula C12H16ClNO and molecular weight 225.09 g/mol. IUPAC: 7-(4-chlorophenyl)-2-methyloxazepane.
Chemical Property Profile of 7-(4-Chlorophenyl)-2-methyloxazepane
Property Insights of 7-(4-Chlorophenyl)-2-methyloxazepane
The XLogP value of 3.3 indicates that 7-(4-Chlorophenyl)-2-methyloxazepane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, 7-(4-Chlorophenyl)-2-methyloxazepane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-(4-Chlorophenyl)-2-methyloxazepane has 0 hydrogen bond donor(s) and 2 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 7-(4-Chlorophenyl)-2-methyloxazepane?
The CAS number of 7-(4-Chlorophenyl)-2-methyloxazepane is 3358-91-6.
What is the molecular formula of 7-(4-Chlorophenyl)-2-methyloxazepane?
The molecular formula of 7-(4-Chlorophenyl)-2-methyloxazepane is C12H16ClNO.
What is the molecular weight of 7-(4-Chlorophenyl)-2-methyloxazepane?
The molecular weight of 7-(4-Chlorophenyl)-2-methyloxazepane is 225.09 g/mol.
Where can I buy 7-(4-Chlorophenyl)-2-methyloxazepane?
You can request a quote for 7-(4-Chlorophenyl)-2-methyloxazepane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-(4-Chlorophenyl)-2-methyloxazepane?
Yes, KEHONG BIO provides custom synthesis services for 7-(4-Chlorophenyl)-2-methyloxazepane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.