甲基黄酮醇胺
TL;DR: 甲基黄酮醇胺 (CAS 106287-81-4) is a chemical compound with molecular formula C22H26ClNO4 and molecular weight 403.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
甲基黄酮醇胺
7-[2-hydroxy-3-(propan-2-ylamino)propoxy]-2-(4-methylphenyl)chromen-4-one;hydrochloride
Also Known As: methylflavonolamine, Sipi 549, Methylflavonolamine HCl, Methylflavonolamine hydrochloride, NIOSH/LK8653000
| Molecular Formula | C22H26ClNO4 |
|---|---|
| Molecular Weight | 403.16 g/mol |
| LogP | 3.92792 |
| Topological Polar Surface Area | 67.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 403.15503 |
| Heavy Atoms | 28 |
| Complexity | 524.0 |
Chemical Identifiers
| CAS Number | 106287-81-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=C(C=C3)OCC(CNC(C)C)O.Cl |
| InChIKey | SYJFBYMNIYYHAV-UHFFFAOYSA-N |
Product Overview
甲基黄酮醇胺 (CAS 106287-81-4), with molecular formula C22H26ClNO4 and molecular weight 403.16 g/mol. IUPAC: 7-[2-hydroxy-3-(propan-2-ylamino)propoxy]-2-(4-methylphenyl)chromen-4-one;hydrochloride.
Chemical Property Profile of 甲基黄酮醇胺
Property Insights of 甲基黄酮醇胺
The XLogP value of 3.92792 indicates that 甲基黄酮醇胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 甲基黄酮醇胺. Following Lipinski's Rule of Five, 甲基黄酮醇胺 has 3 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 甲基黄酮醇胺?
The CAS number of 甲基黄酮醇胺 is 106287-81-4.
What is the molecular formula of 甲基黄酮醇胺?
The molecular formula of 甲基黄酮醇胺 is C22H26ClNO4.
What is the molecular weight of 甲基黄酮醇胺?
The molecular weight of 甲基黄酮醇胺 is 403.16 g/mol.
Where can I buy 甲基黄酮醇胺?
You can request a quote for 甲基黄酮醇胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 甲基黄酮醇胺?
Yes, KEHONG BIO provides custom synthesis services for 甲基黄酮醇胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.