![5-Azatricyclo[6.3.1.04,9]dodeca-2,8(12),10-trien-6-one structure](/static/products/3889/38898-51-0.webp)
5-Azatricyclo[6.3.1.04,9]dodeca-2,8(12),10-trien-6-one
TL;DR: 5-Azatricyclo[6.3.1.04,9]dodeca-2,8(12),10-trien-6-one (CAS 38898-51-0) is a chemical compound with molecular formula C11H11NO and molecular weight 173.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-azatricyclo[6.3.1.04,9]dodeca-2,8(12),10-trien-6-one
Also Known As: RCL T179248, 5-Azatricyclo[6.3.1.04,9]dodeca-2,8(12),10-trien-6-one, 1,4a,7,9a-Tetrahydro-7,4-(metheno)cyclohepta[b]pyridin-2(3H)-one
| Molecular Formula | C11H11NO |
|---|---|
| Molecular Weight | 173.08 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 173.08406 |
| Heavy Atoms | 13 |
| Complexity | 351.0 |
Chemical Identifiers
| CAS Number | 38898-51-0 |
|---|---|
| SMILES | C1C2=CC3C=CC2C(C=C3)NC1=O |
| InChIKey | YZFIDCUKWLNQKV-UHFFFAOYSA-N |
Product Overview
5-Azatricyclo[6.3.1.04,9]dodeca-2,8(12),10-trien-6-one (CAS 38898-51-0), with molecular formula C11H11NO and molecular weight 173.08 g/mol. IUPAC: 5-azatricyclo[6.3.1.04,9]dodeca-2,8(12),10-trien-6-one.
Chemical Property Profile of 5-Azatricyclo[6.3.1.04,9]dodeca-2,8(12),10-trien-6-one
Property Insights of 5-Azatricyclo[6.3.1.04,9]dodeca-2,8(12),10-trien-6-one
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Azatricyclo[6.3.1.04,9]dodeca-2,8(12),10-trien-6-one. With a topological polar surface area (TPSA) of 29.1 Ų, 5-Azatricyclo[6.3.1.04,9]dodeca-2,8(12),10-trien-6-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Azatricyclo[6.3.1.04,9]dodeca-2,8(12),10-trien-6-one has 1 hydrogen bond donor(s) and 1 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 5-Azatricyclo[6.3.1.04,9]dodeca-2,8(12),10-trien-6-one?
The CAS number of 5-Azatricyclo[6.3.1.04,9]dodeca-2,8(12),10-trien-6-one is 38898-51-0.
What is the molecular formula of 5-Azatricyclo[6.3.1.04,9]dodeca-2,8(12),10-trien-6-one?
The molecular formula of 5-Azatricyclo[6.3.1.04,9]dodeca-2,8(12),10-trien-6-one is C11H11NO.
What is the molecular weight of 5-Azatricyclo[6.3.1.04,9]dodeca-2,8(12),10-trien-6-one?
The molecular weight of 5-Azatricyclo[6.3.1.04,9]dodeca-2,8(12),10-trien-6-one is 173.08 g/mol.
Where can I buy 5-Azatricyclo[6.3.1.04,9]dodeca-2,8(12),10-trien-6-one?
You can request a quote for 5-Azatricyclo[6.3.1.04,9]dodeca-2,8(12),10-trien-6-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Azatricyclo[6.3.1.04,9]dodeca-2,8(12),10-trien-6-one?
Yes, KEHONG BIO provides custom synthesis services for 5-Azatricyclo[6.3.1.04,9]dodeca-2,8(12),10-trien-6-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.