![8-(Phenoxycarbonyl)-8-azabicyclo[3.2.1]octane-3-one structure](/static/products/1664/16641-72-8.webp)
8-(Phenoxycarbonyl)-8-azabicyclo[3.2.1]octane-3-one
TL;DR: 8-(Phenoxycarbonyl)-8-azabicyclo[3.2.1]octane-3-one (CAS 16641-72-8) is a chemical compound with molecular formula C14H15NO3 and molecular weight 245.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl 3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate
Also Known As: 8-(Phenoxycarbonyl)-8-azabicyclo[3.2.1]octane-3-one, phenyl 3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate, I14-15221
| Molecular Formula | C14H15NO3 |
|---|---|
| Molecular Weight | 245.11 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 245.1052 |
| Heavy Atoms | 18 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 16641-72-8 |
|---|---|
| SMILES | C1CC2CC(=O)CC1N2C(=O)OC3=CC=CC=C3 |
| InChIKey | GQLAOHBSJQCLON-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
8-(Phenoxycarbonyl)-8-azabicyclo[3.2.1]octane-3-one (CAS 16641-72-8), with molecular formula C14H15NO3 and molecular weight 245.11 g/mol. IUPAC: phenyl 3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate.
Chemical Property Profile of 8-(Phenoxycarbonyl)-8-azabicyclo[3.2.1]octane-3-one
Property Insights of 8-(Phenoxycarbonyl)-8-azabicyclo[3.2.1]octane-3-one
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-(Phenoxycarbonyl)-8-azabicyclo[3.2.1]octane-3-one. With a topological polar surface area (TPSA) of 46.6 Ų, 8-(Phenoxycarbonyl)-8-azabicyclo[3.2.1]octane-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-(Phenoxycarbonyl)-8-azabicyclo[3.2.1]octane-3-one 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
Frequently Asked Questions
What is the CAS number of 8-(Phenoxycarbonyl)-8-azabicyclo[3.2.1]octane-3-one?
The CAS number of 8-(Phenoxycarbonyl)-8-azabicyclo[3.2.1]octane-3-one is 16641-72-8.
What is the molecular formula of 8-(Phenoxycarbonyl)-8-azabicyclo[3.2.1]octane-3-one?
The molecular formula of 8-(Phenoxycarbonyl)-8-azabicyclo[3.2.1]octane-3-one is C14H15NO3.
What is the molecular weight of 8-(Phenoxycarbonyl)-8-azabicyclo[3.2.1]octane-3-one?
The molecular weight of 8-(Phenoxycarbonyl)-8-azabicyclo[3.2.1]octane-3-one is 245.11 g/mol.
Where can I buy 8-(Phenoxycarbonyl)-8-azabicyclo[3.2.1]octane-3-one?
You can request a quote for 8-(Phenoxycarbonyl)-8-azabicyclo[3.2.1]octane-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-(Phenoxycarbonyl)-8-azabicyclo[3.2.1]octane-3-one?
Yes, KEHONG BIO provides custom synthesis services for 8-(Phenoxycarbonyl)-8-azabicyclo[3.2.1]octane-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.