AP-970/42784364
TL;DR: AP-970/42784364 (CAS 774554-91-5) is a chemical compound with molecular formula C21H20BrFN2O2 and molecular weight 430.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[3-bromo-4-[(2-fluorophenyl)methoxy]-5-methoxyphenyl]methyl]-1-pyridin-4-ylmethanamine
Also Known As: AP-970/42784364, N-[[3-bromo-4-[(2-fluorophenyl)methoxy]-5-methoxyphenyl]methyl]-1-pyridin-4-ylmethanamine, N-{3-bromo-4-[(2-fluorobenzyl)oxy]-5-methoxybenzyl}-N-(4-pyridinylmethyl)amine
| Molecular Formula | C21H20BrFN2O2 |
|---|---|
| Molecular Weight | 430.07 g/mol |
| LogP | 4.8606 |
| Topological Polar Surface Area | 43.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 430.0692 |
| Heavy Atoms | 27 |
| Complexity | 890.60504 |
Chemical Identifiers
| CAS Number | 774554-91-5 |
|---|---|
| SMILES | COC1=C(C(=CC(=C1)CNCC2=CC=NC=C2)Br)OCC3=CC=CC=C3F |
Product Overview
AP-970/42784364 (CAS 774554-91-5), with molecular formula C21H20BrFN2O2 and molecular weight 430.07 g/mol. IUPAC: N-[[3-bromo-4-[(2-fluorophenyl)methoxy]-5-methoxyphenyl]methyl]-1-pyridin-4-ylmethanamine.
Chemical Property Profile of AP-970/42784364
Property Insights of AP-970/42784364
The XLogP value of 4.8606 indicates that AP-970/42784364 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.38 Ų, AP-970/42784364 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AP-970/42784364 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-970/42784364?
The CAS number of AP-970/42784364 is 774554-91-5.
What is the molecular formula of AP-970/42784364?
The molecular formula of AP-970/42784364 is C21H20BrFN2O2.
What is the molecular weight of AP-970/42784364?
The molecular weight of AP-970/42784364 is 430.07 g/mol.
Where can I buy AP-970/42784364?
You can request a quote for AP-970/42784364 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-970/42784364?
Yes, KEHONG BIO provides custom synthesis services for AP-970/42784364 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.