Affi-gel 731
TL;DR: Affi-gel 731 (CAS 78560-66-4) is a chemical compound with molecular formula C18H21NO4 and molecular weight 315.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-[2-(dimethylamino)ethoxymethyl]-4,8-dimethylfuro[2,3-h]chromen-2-one
Also Known As: Affi-gel 731, 4,5'-Dimethyl-4'-dimethylaminoethoxymethylangelicin, 2H-Furo(2,3-h)-1-benzopyran-2-one, 4,8-dimethyl-7-((2-(dimethylamino)ethoxy)methyl)-, 4,8-Dimethyl-7-((2-(dimethylamino)ethoxy)methyl)-2H-furo(2,3-h)-1-benzopyran-2-one, 9-(2-dimethylaminoethyloxymethyl)-4,8-dimethylfuro[2,3-h]chromen-2-one
| Molecular Formula | C18H21NO4 |
|---|---|
| Molecular Weight | 315.15 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 51.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 315.14706 |
| Heavy Atoms | 23 |
| Complexity | 476.0 |
Chemical Identifiers
| CAS Number | 78560-66-4 |
|---|---|
| SMILES | CC1=CC(=O)OC2=C1C=CC3=C2C(=C(O3)C)COCCN(C)C |
| InChIKey | YMMNRPUJOKMKJO-UHFFFAOYSA-N |
Product Overview
Affi-gel 731 (CAS 78560-66-4), with molecular formula C18H21NO4 and molecular weight 315.15 g/mol. IUPAC: 9-[2-(dimethylamino)ethoxymethyl]-4,8-dimethylfuro[2,3-h]chromen-2-one.
Chemical Property Profile of Affi-gel 731
Property Insights of Affi-gel 731
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Affi-gel 731. With a topological polar surface area (TPSA) of 51.9 Ų, Affi-gel 731 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Affi-gel 731 has 0 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 Affi-gel 731?
The CAS number of Affi-gel 731 is 78560-66-4.
What is the molecular formula of Affi-gel 731?
The molecular formula of Affi-gel 731 is C18H21NO4.
What is the molecular weight of Affi-gel 731?
The molecular weight of Affi-gel 731 is 315.15 g/mol.
Where can I buy Affi-gel 731?
You can request a quote for Affi-gel 731 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Affi-gel 731?
Yes, KEHONG BIO provides custom synthesis services for Affi-gel 731 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.