AB00914681-05
TL;DR: AB00914681-05 (CAS 898441-93-5) is a chemical compound with molecular formula C23H24N2O5 and molecular weight 408.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(furan-2-carbonyl)piperazin-1-yl]methyl]-5-[(3-methylphenyl)methoxy]pyran-4-one
Also Known As: AB00914681-05, F2617-1110, 2-[[4-(furan-2-carbonyl)piperazin-1-yl]methyl]-5-[(3-methylphenyl)methoxy]pyran-4-one, 2-((4-(furan-2-carbonyl)piperazin-1-yl)methyl)-5-((3-methylbenzyl)oxy)-4H-pyran-4-one, 2-{[4-(furan-2-carbonyl)piperazin-1-yl]methyl}-5-[(3-methylphenyl)methoxy]-4H-pyran-4-one
| Molecular Formula | C23H24N2O5 |
|---|---|
| Molecular Weight | 408.17 g/mol |
| LogP | 3.07822 |
| Topological Polar Surface Area | 76.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 408.16852 |
| Heavy Atoms | 30 |
| Complexity | 1049.4603 |
Chemical Identifiers
| CAS Number | 898441-93-5 |
|---|---|
| SMILES | CC1=CC(=CC=C1)COC2=COC(=CC2=O)CN3CCN(CC3)C(=O)C4=CC=CO4 |
Product Overview
AB00914681-05 (CAS 898441-93-5), with molecular formula C23H24N2O5 and molecular weight 408.17 g/mol. IUPAC: 2-[[4-(furan-2-carbonyl)piperazin-1-yl]methyl]-5-[(3-methylphenyl)methoxy]pyran-4-one.
Chemical Property Profile of AB00914681-05
Property Insights of AB00914681-05
The XLogP value of 3.07822 indicates that AB00914681-05 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.13 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00914681-05. Following Lipinski's Rule of Five, AB00914681-05 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 AB00914681-05?
The CAS number of AB00914681-05 is 898441-93-5.
What is the molecular formula of AB00914681-05?
The molecular formula of AB00914681-05 is C23H24N2O5.
What is the molecular weight of AB00914681-05?
The molecular weight of AB00914681-05 is 408.17 g/mol.
Where can I buy AB00914681-05?
You can request a quote for AB00914681-05 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00914681-05?
Yes, KEHONG BIO provides custom synthesis services for AB00914681-05 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.