BuflomedilimpurityB
TL;DR: BuflomedilimpurityB (CAS 79967-07-0) is a chemical compound with molecular formula C16H23NO4 and molecular weight 293.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-hydroxy-2,6-dimethoxyphenyl)-4-pyrrolidin-1-ylbutan-1-one
Also Known As: BuflomedilimpurityB, P-DEMETHYLBUFLOMEDIL, Buflomedil impurity B, Buflomedil EP Impurity B, Buflomedil impurity B CRS
| Molecular Formula | C16H23NO4 |
|---|---|
| Molecular Weight | 293.16 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 59.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 293.16272 |
| Heavy Atoms | 21 |
| Complexity | 316.0 |
Chemical Identifiers
| CAS Number | 79967-07-0 |
|---|---|
| SMILES | COC1=CC(=CC(=C1C(=O)CCCN2CCCC2)OC)O |
| InChIKey | BJXQAMLBAONSIX-UHFFFAOYSA-N |
Product Overview
BuflomedilimpurityB (CAS 79967-07-0), with molecular formula C16H23NO4 and molecular weight 293.16 g/mol. IUPAC: 1-(4-hydroxy-2,6-dimethoxyphenyl)-4-pyrrolidin-1-ylbutan-1-one.
Chemical Property Profile of BuflomedilimpurityB
Property Insights of BuflomedilimpurityB
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BuflomedilimpurityB. With a topological polar surface area (TPSA) of 59.0 Ų, BuflomedilimpurityB exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BuflomedilimpurityB has 1 hydrogen bond donor(s) and 5 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 BuflomedilimpurityB?
The CAS number of BuflomedilimpurityB is 79967-07-0.
What is the molecular formula of BuflomedilimpurityB?
The molecular formula of BuflomedilimpurityB is C16H23NO4.
What is the molecular weight of BuflomedilimpurityB?
The molecular weight of BuflomedilimpurityB is 293.16 g/mol.
Where can I buy BuflomedilimpurityB?
You can request a quote for BuflomedilimpurityB directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BuflomedilimpurityB?
Yes, KEHONG BIO provides custom synthesis services for BuflomedilimpurityB and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.