AP-970/42224731
TL;DR: AP-970/42224731 (CAS 774547-10-3) is a chemical compound with molecular formula C21H26ClNO4 and molecular weight 391.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-chloro-5-methoxy-4-prop-2-enoxyphenyl)methyl]-2-(3,4-dimethoxyphenyl)ethanamine
Also Known As: AP-970/42224731, N-[(3-chloro-5-methoxy-4-prop-2-enoxyphenyl)methyl]-2-(3,4-dimethoxyphenyl)ethanamine, (4-Allyloxy-3-chloro-5-methoxy-benzyl)-[2-(3,4-dimethoxy-phenyl)-ethyl]-amine, N-[3-chloro-5-methoxy-4-(prop-2-en-1-yloxy)benzyl]-2-(3,4-dimethoxyphenyl)ethanamine, N-[4-(allyloxy)-3-chloro-5-methoxybenzyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]amine
| Molecular Formula | C21H26ClNO4 |
|---|---|
| Molecular Weight | 391.16 g/mol |
| LogP | 4.2629 |
| Topological Polar Surface Area | 48.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 391.15503 |
| Heavy Atoms | 27 |
| Complexity | 764.0871 |
Chemical Identifiers
| CAS Number | 774547-10-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCNCC2=CC(=C(C(=C2)Cl)OCC=C)OC)OC |
Product Overview
AP-970/42224731 (CAS 774547-10-3), with molecular formula C21H26ClNO4 and molecular weight 391.16 g/mol. IUPAC: N-[(3-chloro-5-methoxy-4-prop-2-enoxyphenyl)methyl]-2-(3,4-dimethoxyphenyl)ethanamine.
Chemical Property Profile of AP-970/42224731
Property Insights of AP-970/42224731
The XLogP value of 4.2629 indicates that AP-970/42224731 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.95 Ų, AP-970/42224731 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AP-970/42224731 has 1 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 AP-970/42224731?
The CAS number of AP-970/42224731 is 774547-10-3.
What is the molecular formula of AP-970/42224731?
The molecular formula of AP-970/42224731 is C21H26ClNO4.
What is the molecular weight of AP-970/42224731?
The molecular weight of AP-970/42224731 is 391.16 g/mol.
Where can I buy AP-970/42224731?
You can request a quote for AP-970/42224731 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-970/42224731?
Yes, KEHONG BIO provides custom synthesis services for AP-970/42224731 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.