7-Phenyl-9,10-dioxo-1-aza-8-oxabicyclo(5.2.1)decane
TL;DR: 7-Phenyl-9,10-dioxo-1-aza-8-oxabicyclo(5.2.1)decane (CAS 120666-79-7) 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.
7-phenyl-8-oxa-1-azabicyclo[5.2.1]decane-9,10-dione
Also Known As: PDAOD, 7-phenyl-8-oxa-1-azabicyclo[5.2.1]decane-9,10-dione, 7-Phenyl-9,10-dioxo-1-aza-8-oxabicyclo(5.2.1)decane, 8-Oxa-1-azabicyclo[5.2.1]decane-9,10-dione,7-phenyl-, 8-Oxa-1-azabicyclo(5.2.1)decane-9,10-dione, 7-phenyl-, (+-)-
| Molecular Formula | C14H15NO3 |
|---|---|
| Molecular Weight | 245.11 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 245.1052 |
| Heavy Atoms | 18 |
| Complexity | 362.0 |
Chemical Identifiers
| CAS Number | 120666-79-7 |
|---|---|
| SMILES | C1CCC2(C(=O)N(CC1)C(=O)O2)C3=CC=CC=C3 |
| InChIKey | JHTPNSZLWPWZLV-UHFFFAOYSA-N |
Product Overview
7-Phenyl-9,10-dioxo-1-aza-8-oxabicyclo(5.2.1)decane (CAS 120666-79-7), with molecular formula C14H15NO3 and molecular weight 245.11 g/mol. IUPAC: 7-phenyl-8-oxa-1-azabicyclo[5.2.1]decane-9,10-dione.
Chemical Property Profile of 7-Phenyl-9,10-dioxo-1-aza-8-oxabicyclo(5.2.1)decane
Property Insights of 7-Phenyl-9,10-dioxo-1-aza-8-oxabicyclo(5.2.1)decane
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Phenyl-9,10-dioxo-1-aza-8-oxabicyclo(5.2.1)decane. With a topological polar surface area (TPSA) of 46.6 Ų, 7-Phenyl-9,10-dioxo-1-aza-8-oxabicyclo(5.2.1)decane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Phenyl-9,10-dioxo-1-aza-8-oxabicyclo(5.2.1)decane 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 7-Phenyl-9,10-dioxo-1-aza-8-oxabicyclo(5.2.1)decane?
The CAS number of 7-Phenyl-9,10-dioxo-1-aza-8-oxabicyclo(5.2.1)decane is 120666-79-7.
What is the molecular formula of 7-Phenyl-9,10-dioxo-1-aza-8-oxabicyclo(5.2.1)decane?
The molecular formula of 7-Phenyl-9,10-dioxo-1-aza-8-oxabicyclo(5.2.1)decane is C14H15NO3.
What is the molecular weight of 7-Phenyl-9,10-dioxo-1-aza-8-oxabicyclo(5.2.1)decane?
The molecular weight of 7-Phenyl-9,10-dioxo-1-aza-8-oxabicyclo(5.2.1)decane is 245.11 g/mol.
Where can I buy 7-Phenyl-9,10-dioxo-1-aza-8-oxabicyclo(5.2.1)decane?
You can request a quote for 7-Phenyl-9,10-dioxo-1-aza-8-oxabicyclo(5.2.1)decane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Phenyl-9,10-dioxo-1-aza-8-oxabicyclo(5.2.1)decane?
Yes, KEHONG BIO provides custom synthesis services for 7-Phenyl-9,10-dioxo-1-aza-8-oxabicyclo(5.2.1)decane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.