AP-970/42777434
TL;DR: AP-970/42777434 (CAS 708291-60-5) is a chemical compound with molecular formula C22H21BrFN3O2 and molecular weight 457.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-N-[4-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]phenyl]furan-2-carboxamide
Also Known As: AP-970/42777434, 5-bromo-N-[4-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]phenyl]furan-2-carboxamide, 5-bromo-N-{4-[4-(2-fluorobenzyl)-1-piperazinyl]phenyl}-2-furamide, 5-bromo-N-{4-[4-(2-fluorobenzyl)piperazin-1-yl]phenyl}furan-2-carboxamide
| Molecular Formula | C22H21BrFN3O2 |
|---|---|
| Molecular Weight | 457.08 g/mol |
| LogP | 4.7557 |
| Topological Polar Surface Area | 48.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 457.0801 |
| Heavy Atoms | 29 |
| Complexity | 981.7323 |
Chemical Identifiers
| CAS Number | 708291-60-5 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=CC=C2F)C3=CC=C(C=C3)NC(=O)C4=CC=C(O4)Br |
Product Overview
AP-970/42777434 (CAS 708291-60-5), with molecular formula C22H21BrFN3O2 and molecular weight 457.08 g/mol. IUPAC: 5-bromo-N-[4-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]phenyl]furan-2-carboxamide.
Chemical Property Profile of AP-970/42777434
Property Insights of AP-970/42777434
The XLogP value of 4.7557 indicates that AP-970/42777434 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.72 Ų, AP-970/42777434 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AP-970/42777434 has 1 hydrogen bond donor(s) and 4 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 AP-970/42777434?
The CAS number of AP-970/42777434 is 708291-60-5.
What is the molecular formula of AP-970/42777434?
The molecular formula of AP-970/42777434 is C22H21BrFN3O2.
What is the molecular weight of AP-970/42777434?
The molecular weight of AP-970/42777434 is 457.08 g/mol.
Where can I buy AP-970/42777434?
You can request a quote for AP-970/42777434 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-970/42777434?
Yes, KEHONG BIO provides custom synthesis services for AP-970/42777434 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.