ChemDiv1_006597
TL;DR: ChemDiv1_006597 (CAS 307535-05-3) is a chemical compound with molecular formula C25H26F3NO5 and molecular weight 477.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,4-dimethoxyphenyl)-7-hydroxy-8-[(4-methylpiperidin-1-yl)methyl]-2-(trifluoromethyl)chromen-4-one
Also Known As: ChemDiv1_006597, 3-(3,4-dimethoxyphenyl)-7-hydroxy-8-[(4-methylpiperidin-1-yl)methyl]-2-(trifluoromethyl)-4H-chromen-4-one, 3-(3,4-dimethoxyphenyl)-7-hydroxy-8-[(4-methylpiperidin-1-yl)methyl]-2-(trifluoromethyl)chromen-4-one, 3-(3,4-dimethoxyphenyl)-7-hydroxy-8-((4-methylpiperidin-1-yl)methyl)-2-(trifluoromethyl)-4H-chromen-4-one, 3-(3,4-dimethoxyphenyl)-7-hydroxy-8-[(4-methylpiperidyl)methyl]-2-(trifluorome thyl)chromen-4-one
| Molecular Formula | C25H26F3NO5 |
|---|---|
| Molecular Weight | 477.18 g/mol |
| LogP | 5.4335 |
| Topological Polar Surface Area | 72.14 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 477.1763 |
| Heavy Atoms | 34 |
| Complexity | 1260.1116 |
Chemical Identifiers
| CAS Number | 307535-05-3 |
|---|---|
| SMILES | CC1CCN(CC1)CC2=C(C=CC3=C2OC(=C(C3=O)C4=CC(=C(C=C4)OC)OC)C(F)(F)F)O |
Product Overview
ChemDiv1_006597 (CAS 307535-05-3), with molecular formula C25H26F3NO5 and molecular weight 477.18 g/mol. IUPAC: 3-(3,4-dimethoxyphenyl)-7-hydroxy-8-[(4-methylpiperidin-1-yl)methyl]-2-(trifluoromethyl)chromen-4-one.
Chemical Property Profile of ChemDiv1_006597
Property Insights of ChemDiv1_006597
The XLogP value of 5.4335 indicates that ChemDiv1_006597 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.14 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_006597. Following Lipinski's Rule of Five, ChemDiv1_006597 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_006597?
The CAS number of ChemDiv1_006597 is 307535-05-3.
What is the molecular formula of ChemDiv1_006597?
The molecular formula of ChemDiv1_006597 is C25H26F3NO5.
What is the molecular weight of ChemDiv1_006597?
The molecular weight of ChemDiv1_006597 is 477.18 g/mol.
Where can I buy ChemDiv1_006597?
You can request a quote for ChemDiv1_006597 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_006597?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_006597 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.