4,6,6-Trimethyl-7-morpholin-4-yl-1,4-oxazepane
TL;DR: 4,6,6-Trimethyl-7-morpholin-4-yl-1,4-oxazepane (CAS 76503-76-9) is a chemical compound with molecular formula C12H24N2O2 and molecular weight 228.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6,6-trimethyl-7-morpholin-4-yl-1,4-oxazepane
Also Known As: 4,6,6-trimethyl-7-morpholin-4-yl-1,4-oxazepane, 4,6,6-Trimethyl-7-(morpholin-4-yl)-1,4-oxazepane
| Molecular Formula | C12H24N2O2 |
|---|---|
| Molecular Weight | 228.18 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 24.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 228.18378 |
| Heavy Atoms | 16 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 76503-76-9 |
|---|---|
| SMILES | CC1(CN(CCOC1N2CCOCC2)C)C |
| InChIKey | BYVNEBGBBCYIQI-UHFFFAOYSA-N |
Product Overview
4,6,6-Trimethyl-7-morpholin-4-yl-1,4-oxazepane (CAS 76503-76-9), with molecular formula C12H24N2O2 and molecular weight 228.18 g/mol. IUPAC: 4,6,6-trimethyl-7-morpholin-4-yl-1,4-oxazepane.
Chemical Property Profile of 4,6,6-Trimethyl-7-morpholin-4-yl-1,4-oxazepane
Property Insights of 4,6,6-Trimethyl-7-morpholin-4-yl-1,4-oxazepane
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,6,6-Trimethyl-7-morpholin-4-yl-1,4-oxazepane. With a topological polar surface area (TPSA) of 24.9 Ų, 4,6,6-Trimethyl-7-morpholin-4-yl-1,4-oxazepane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,6,6-Trimethyl-7-morpholin-4-yl-1,4-oxazepane 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 4,6,6-Trimethyl-7-morpholin-4-yl-1,4-oxazepane?
The CAS number of 4,6,6-Trimethyl-7-morpholin-4-yl-1,4-oxazepane is 76503-76-9.
What is the molecular formula of 4,6,6-Trimethyl-7-morpholin-4-yl-1,4-oxazepane?
The molecular formula of 4,6,6-Trimethyl-7-morpholin-4-yl-1,4-oxazepane is C12H24N2O2.
What is the molecular weight of 4,6,6-Trimethyl-7-morpholin-4-yl-1,4-oxazepane?
The molecular weight of 4,6,6-Trimethyl-7-morpholin-4-yl-1,4-oxazepane is 228.18 g/mol.
Where can I buy 4,6,6-Trimethyl-7-morpholin-4-yl-1,4-oxazepane?
You can request a quote for 4,6,6-Trimethyl-7-morpholin-4-yl-1,4-oxazepane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6,6-Trimethyl-7-morpholin-4-yl-1,4-oxazepane?
Yes, KEHONG BIO provides custom synthesis services for 4,6,6-Trimethyl-7-morpholin-4-yl-1,4-oxazepane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.