丁菲洛尔
TL;DR: 丁菲洛尔 (CAS 58930-32-8) is a chemical compound with molecular formula C17H26FNO3 and molecular weight 311.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
丁菲洛尔
1-[2-[3-(tert-butylamino)-2-hydroxypropoxy]-5-fluorophenyl]butan-1-one
Also Known As: Butofilolol, Cafide, Butofilololum, Butofilolol [INN], Butofilololum [INN-Latin]
| Molecular Formula | C17H26FNO3 |
|---|---|
| Molecular Weight | 311.19 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 311.18967 |
| Heavy Atoms | 22 |
| Complexity | 343.0 |
Chemical Identifiers
| CAS Number | 58930-32-8 |
|---|---|
| SMILES | CCCC(=O)C1=C(C=CC(=C1)F)OCC(CNC(C)(C)C)O |
| InChIKey | NMBNQRJDEPOXCP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
丁菲洛尔 (CAS 58930-32-8), with molecular formula C17H26FNO3 and molecular weight 311.19 g/mol. IUPAC: 1-[2-[3-(tert-butylamino)-2-hydroxypropoxy]-5-fluorophenyl]butan-1-one.
Chemical Property Profile of 丁菲洛尔
Property Insights of 丁菲洛尔
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 丁菲洛尔. With a topological polar surface area (TPSA) of 58.6 Ų, 丁菲洛尔 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 丁菲洛尔 has 2 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 丁菲洛尔?
The CAS number of 丁菲洛尔 is 58930-32-8.
What is the molecular formula of 丁菲洛尔?
The molecular formula of 丁菲洛尔 is C17H26FNO3.
What is the molecular weight of 丁菲洛尔?
The molecular weight of 丁菲洛尔 is 311.19 g/mol.
Where can I buy 丁菲洛尔?
You can request a quote for 丁菲洛尔 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 丁菲洛尔?
Yes, KEHONG BIO provides custom synthesis services for 丁菲洛尔 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.