1-(3,5-Dimethoxyphenyl)-3,3-dimethyl-2-azetanone
TL;DR: 1-(3,5-Dimethoxyphenyl)-3,3-dimethyl-2-azetanone (CAS 478261-91-5) is a chemical compound with molecular formula C13H17NO3 and molecular weight 235.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,5-dimethoxyphenyl)-3,3-dimethylazetidin-2-one
Also Known As: 1-(3,5-dimethoxyphenyl)-3,3-dimethyl-2-azetanone, 1-(3,5-dimethoxyphenyl)-3,3-dimethylazetidin-2-one, 1-(3,5-dimethoxyphenyl)-3,3-dimethyl-azetidin-2-one
| Molecular Formula | C13H17NO3 |
|---|---|
| Molecular Weight | 235.12 g/mol |
| LogP | 2.0766 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 235.12085 |
| Heavy Atoms | 17 |
| Complexity | 431.72784 |
Chemical Identifiers
| CAS Number | 478261-91-5 |
|---|---|
| SMILES | CC1(CN(C1=O)C2=CC(=CC(=C2)OC)OC)C |
Product Overview
1-(3,5-Dimethoxyphenyl)-3,3-dimethyl-2-azetanone (CAS 478261-91-5), with molecular formula C13H17NO3 and molecular weight 235.12 g/mol. IUPAC: 1-(3,5-dimethoxyphenyl)-3,3-dimethylazetidin-2-one.
Chemical Property Profile of 1-(3,5-Dimethoxyphenyl)-3,3-dimethyl-2-azetanone
Property Insights of 1-(3,5-Dimethoxyphenyl)-3,3-dimethyl-2-azetanone
The XLogP value of 2.0766 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3,5-Dimethoxyphenyl)-3,3-dimethyl-2-azetanone. With a topological polar surface area (TPSA) of 38.77 Ų, 1-(3,5-Dimethoxyphenyl)-3,3-dimethyl-2-azetanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,5-Dimethoxyphenyl)-3,3-dimethyl-2-azetanone 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-(3,5-Dimethoxyphenyl)-3,3-dimethyl-2-azetanone?
The CAS number of 1-(3,5-Dimethoxyphenyl)-3,3-dimethyl-2-azetanone is 478261-91-5.
What is the molecular formula of 1-(3,5-Dimethoxyphenyl)-3,3-dimethyl-2-azetanone?
The molecular formula of 1-(3,5-Dimethoxyphenyl)-3,3-dimethyl-2-azetanone is C13H17NO3.
What is the molecular weight of 1-(3,5-Dimethoxyphenyl)-3,3-dimethyl-2-azetanone?
The molecular weight of 1-(3,5-Dimethoxyphenyl)-3,3-dimethyl-2-azetanone is 235.12 g/mol.
Where can I buy 1-(3,5-Dimethoxyphenyl)-3,3-dimethyl-2-azetanone?
You can request a quote for 1-(3,5-Dimethoxyphenyl)-3,3-dimethyl-2-azetanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,5-Dimethoxyphenyl)-3,3-dimethyl-2-azetanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,5-Dimethoxyphenyl)-3,3-dimethyl-2-azetanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.