![5-Benzyl-5-azaspiro[2.4]heptane-4,7-dione structure](/static/products/129/129306-04-3.png)
5-Benzyl-5-azaspiro[2.4]heptane-4,7-dione
TL;DR: 5-Benzyl-5-azaspiro[2.4]heptane-4,7-dione (CAS 129306-04-3) is a chemical compound with molecular formula C13H13NO2 and molecular weight 215.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-benzyl-5-azaspiro[2.4]heptane-4,7-dione
Also Known As: 5-benzyl-5-azaspiro[2.4]heptane-4,7-dione, 5-Azaspiro[2.4]heptane-4,7-dione, 5-(phenylmethyl)-, 5-(phenylmethyl)-5-azaspiro[2.4]heptane-4,7-dione, 5-benzyl-4,7-dioxo-5-azaspiro[2.4]heptane, 6-benzyl-6-azaspiro[2.4]heptane-4,7-dione
| Molecular Formula | C13H13NO2 |
|---|---|
| Molecular Weight | 215.09 g/mol |
| LogP | 1.3781 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 215.09464 |
| Heavy Atoms | 16 |
| Complexity | 448.26022 |
Chemical Identifiers
| CAS Number | 129306-04-3 |
|---|---|
| SMILES | C1CC12C(=O)CN(C2=O)CC3=CC=CC=C3 |
Product Overview
5-Benzyl-5-azaspiro[2.4]heptane-4,7-dione (CAS 129306-04-3), with molecular formula C13H13NO2 and molecular weight 215.09 g/mol. IUPAC: 5-benzyl-5-azaspiro[2.4]heptane-4,7-dione.
Chemical Property Profile of 5-Benzyl-5-azaspiro[2.4]heptane-4,7-dione
Property Insights of 5-Benzyl-5-azaspiro[2.4]heptane-4,7-dione
The XLogP value of 1.3781 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Benzyl-5-azaspiro[2.4]heptane-4,7-dione. With a topological polar surface area (TPSA) of 37.38 Ų, 5-Benzyl-5-azaspiro[2.4]heptane-4,7-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Benzyl-5-azaspiro[2.4]heptane-4,7-dione has 0 hydrogen bond donor(s) and 2 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-Benzyl-5-azaspiro[2.4]heptane-4,7-dione?
The CAS number of 5-Benzyl-5-azaspiro[2.4]heptane-4,7-dione is 129306-04-3.
What is the molecular formula of 5-Benzyl-5-azaspiro[2.4]heptane-4,7-dione?
The molecular formula of 5-Benzyl-5-azaspiro[2.4]heptane-4,7-dione is C13H13NO2.
What is the molecular weight of 5-Benzyl-5-azaspiro[2.4]heptane-4,7-dione?
The molecular weight of 5-Benzyl-5-azaspiro[2.4]heptane-4,7-dione is 215.09 g/mol.
Where can I buy 5-Benzyl-5-azaspiro[2.4]heptane-4,7-dione?
You can request a quote for 5-Benzyl-5-azaspiro[2.4]heptane-4,7-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Benzyl-5-azaspiro[2.4]heptane-4,7-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-Benzyl-5-azaspiro[2.4]heptane-4,7-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.