2-Bromo-9-(4-morpholinylcarbonyl)-4-oxatricyclo[4.2.1.0~3,7~]nonan-5-one
TL;DR: 2-Bromo-9-(4-morpholinylcarbonyl)-4-oxatricyclo[4.2.1.0~3,7~]nonan-5-one (CAS 1005073-79-9) is a chemical compound with molecular formula C13H16BrNO4 and molecular weight 329.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-9-(morpholine-4-carbonyl)-4-oxatricyclo[4.2.1.03,7]nonan-5-one
Also Known As: 2-bromo-9-(4-morpholinylcarbonyl)-4-oxatricyclo[4.2.1.0~3,7~]nonan-5-one, 2-bromo-9-(morpholine-4-carbonyl)-4-oxatricyclo[4.2.1.03,7]nonan-5-one, 6-bromo-7-(morpholin-4-ylcarbonyl)hexahydro-2H-3,5-methanocyclopenta[b]furan-2-one, 6-bromo-7-(morpholine-4-carbonyl)hexahydro-2H-3,5-methanocyclopenta[b]furan-2-one, (6S,7S)-6-bromo-7-(morpholine-4-carbonyl)hexahydro-2H-3,5-methanocyclopenta[b]furan-2-one
| Molecular Formula | C13H16BrNO4 |
|---|---|
| Molecular Weight | 329.03 g/mol |
| LogP | 0.4162 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 329.02628 |
| Heavy Atoms | 19 |
| Complexity | 436.35916 |
Chemical Identifiers
| CAS Number | 1005073-79-9 |
|---|---|
| SMILES | C1COCCN1C(=O)C2C3CC4C2C(=O)OC4C3Br |
Product Overview
2-Bromo-9-(4-morpholinylcarbonyl)-4-oxatricyclo[4.2.1.0~3,7~]nonan-5-one (CAS 1005073-79-9), with molecular formula C13H16BrNO4 and molecular weight 329.03 g/mol. IUPAC: 2-bromo-9-(morpholine-4-carbonyl)-4-oxatricyclo[4.2.1.03,7]nonan-5-one.
Chemical Property Profile of 2-Bromo-9-(4-morpholinylcarbonyl)-4-oxatricyclo[4.2.1.0~3,7~]nonan-5-one
Property Insights of 2-Bromo-9-(4-morpholinylcarbonyl)-4-oxatricyclo[4.2.1.0~3,7~]nonan-5-one
The XLogP value of 0.4162 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromo-9-(4-morpholinylcarbonyl)-4-oxatricyclo[4.2.1.0~3,7~]nonan-5-one. With a topological polar surface area (TPSA) of 55.84 Ų, 2-Bromo-9-(4-morpholinylcarbonyl)-4-oxatricyclo[4.2.1.0~3,7~]nonan-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-9-(4-morpholinylcarbonyl)-4-oxatricyclo[4.2.1.0~3,7~]nonan-5-one 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 2-Bromo-9-(4-morpholinylcarbonyl)-4-oxatricyclo[4.2.1.0~3,7~]nonan-5-one?
The CAS number of 2-Bromo-9-(4-morpholinylcarbonyl)-4-oxatricyclo[4.2.1.0~3,7~]nonan-5-one is 1005073-79-9.
What is the molecular formula of 2-Bromo-9-(4-morpholinylcarbonyl)-4-oxatricyclo[4.2.1.0~3,7~]nonan-5-one?
The molecular formula of 2-Bromo-9-(4-morpholinylcarbonyl)-4-oxatricyclo[4.2.1.0~3,7~]nonan-5-one is C13H16BrNO4.
What is the molecular weight of 2-Bromo-9-(4-morpholinylcarbonyl)-4-oxatricyclo[4.2.1.0~3,7~]nonan-5-one?
The molecular weight of 2-Bromo-9-(4-morpholinylcarbonyl)-4-oxatricyclo[4.2.1.0~3,7~]nonan-5-one is 329.03 g/mol.
Where can I buy 2-Bromo-9-(4-morpholinylcarbonyl)-4-oxatricyclo[4.2.1.0~3,7~]nonan-5-one?
You can request a quote for 2-Bromo-9-(4-morpholinylcarbonyl)-4-oxatricyclo[4.2.1.0~3,7~]nonan-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-9-(4-morpholinylcarbonyl)-4-oxatricyclo[4.2.1.0~3,7~]nonan-5-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-9-(4-morpholinylcarbonyl)-4-oxatricyclo[4.2.1.0~3,7~]nonan-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.