RefChem:267516
TL;DR: RefChem:267516 (CAS 78808-03-4) is a chemical compound with molecular formula C25H26N2O4 and molecular weight 418.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-9-[[4-(3-methylphenyl)piperazin-1-yl]methyl]-8,9-dihydropyrano[2,3-f]chromene-2,10-dione
Also Known As: 2H,10H-Benzo(1,2-b:3,4-b')dipyran-2,10-dione, 8,9-dihydro-4-methyl-9-((4-(3-methylphenyl)-1-piperazinyl)methyl)-, 4-methyl-9-[[4-(3-methylphenyl)piperazin-1-yl]methyl]-8,9-dihydropyrano[2,3-f]chromene-2,10-dione, 4-Methyl-9-{[4-(3-methylphenyl)piperazin-1-yl]methyl}-8,9-dihydro-2H,10H-benzo[1,2-b:3,4-b']dipyran-2,10-dione, RefChem:267516
| Molecular Formula | C25H26N2O4 |
|---|---|
| Molecular Weight | 418.19 g/mol |
| LogP | 3.42334 |
| Topological Polar Surface Area | 62.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 418.18927 |
| Heavy Atoms | 31 |
| Complexity | 1207.8578 |
Chemical Identifiers
| CAS Number | 78808-03-4 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2CCN(CC2)CC3COC4=C(C3=O)C5=C(C=C4)C(=CC(=O)O5)C |
Product Overview
RefChem:267516 (CAS 78808-03-4), with molecular formula C25H26N2O4 and molecular weight 418.19 g/mol. IUPAC: 4-methyl-9-[[4-(3-methylphenyl)piperazin-1-yl]methyl]-8,9-dihydropyrano[2,3-f]chromene-2,10-dione.
Chemical Property Profile of RefChem:267516
Property Insights of RefChem:267516
The XLogP value of 3.42334 indicates that RefChem:267516 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.99 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:267516. Following Lipinski's Rule of Five, RefChem:267516 has 0 hydrogen bond donor(s) and 6 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 RefChem:267516?
The CAS number of RefChem:267516 is 78808-03-4.
What is the molecular formula of RefChem:267516?
The molecular formula of RefChem:267516 is C25H26N2O4.
What is the molecular weight of RefChem:267516?
The molecular weight of RefChem:267516 is 418.19 g/mol.
Where can I buy RefChem:267516?
You can request a quote for RefChem:267516 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:267516?
Yes, KEHONG BIO provides custom synthesis services for RefChem:267516 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.