![1-Benzyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one structure](/static/products/1263/1263280-06-3.webp)
1-Benzyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one
TL;DR: 1-Benzyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one (CAS 1263280-06-3) is a chemical compound with molecular formula C16H20N2O and molecular weight 256.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-3,6-diazatricyclo[4.3.1.13,8]undecan-9-one
Also Known As: 1-benzyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one, 4,6-Tricosadiyn-1-ol, CHEMBRDG-BB5473191, CHEMBRDG-BB 5473191, 1-Benzyl-3,6-diazatricyclo[4.3.1.13,8]undecan-9-one
| Molecular Formula | C16H20N2O |
|---|---|
| Molecular Weight | 256.16 g/mol |
| LogP | 1.0456 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 256.15756 |
| Heavy Atoms | 19 |
| Complexity | 482.73022 |
Chemical Identifiers
| CAS Number | 1263280-06-3 |
|---|---|
| SMILES | C1CN2CC3CN1CC(C2)(C3=O)CC4=CC=CC=C4 |
Product Overview
1-Benzyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one (CAS 1263280-06-3), with molecular formula C16H20N2O and molecular weight 256.16 g/mol. IUPAC: 1-benzyl-3,6-diazatricyclo[4.3.1.13,8]undecan-9-one.
Chemical Property Profile of 1-Benzyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one
Property Insights of 1-Benzyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one
The XLogP value of 1.0456 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Benzyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one. With a topological polar surface area (TPSA) of 23.55 Ų, 1-Benzyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-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 1-Benzyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one?
The CAS number of 1-Benzyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one is 1263280-06-3.
What is the molecular formula of 1-Benzyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one?
The molecular formula of 1-Benzyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one is C16H20N2O.
What is the molecular weight of 1-Benzyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one?
The molecular weight of 1-Benzyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one is 256.16 g/mol.
Where can I buy 1-Benzyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one?
You can request a quote for 1-Benzyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-3,6-diazatricyclo[4.3.1.1~3,8~]undecan-9-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.