AO-081/40800234
TL;DR: AO-081/40800234 (CAS 488096-77-1) is a chemical compound with molecular formula C29H24Cl2N2O3 and molecular weight 518.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[(3,4-dichlorophenyl)methoxy]-3-ethoxyphenyl]-3-phenyl-1,2-dihydroquinazolin-4-one
Also Known As: AO-081/40800234, 2-{4-[(3,4-dichlorobenzyl)oxy]-3-ethoxyphenyl}-3-phenyl-2,3-dihydro-4(1H)-quinazolinone, 2-[4-[(3,4-dichlorophenyl)methoxy]-3-ethoxyphenyl]-3-phenyl-1,2-dihydroquinazolin-4-one, 2-(4-((3,4-dichlorobenzyl)oxy)-3-ethoxyphenyl)-3-phenyl-2,3-dihydroquinazolin-4(1H)-one, 2-{4-[(3,4-dichlorobenzyl)oxy]-3-ethoxyphenyl}-3-phenyl-2,3-dihydroquinazolin-4(1H)-one
| Molecular Formula | C29H24Cl2N2O3 |
|---|---|
| Molecular Weight | 518.12 g/mol |
| LogP | 7.7422 |
| Topological Polar Surface Area | 50.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 518.1164 |
| Heavy Atoms | 36 |
| Complexity | 1394.6703 |
Chemical Identifiers
| CAS Number | 488096-77-1 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)C2NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4)OCC5=CC(=C(C=C5)Cl)Cl |
Product Overview
AO-081/40800234 (CAS 488096-77-1), with molecular formula C29H24Cl2N2O3 and molecular weight 518.12 g/mol. IUPAC: 2-[4-[(3,4-dichlorophenyl)methoxy]-3-ethoxyphenyl]-3-phenyl-1,2-dihydroquinazolin-4-one.
Chemical Property Profile of AO-081/40800234
Property Insights of AO-081/40800234
The XLogP value of 7.7422 indicates that AO-081/40800234 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.8 Ų, AO-081/40800234 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AO-081/40800234 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AO-081/40800234?
The CAS number of AO-081/40800234 is 488096-77-1.
What is the molecular formula of AO-081/40800234?
The molecular formula of AO-081/40800234 is C29H24Cl2N2O3.
What is the molecular weight of AO-081/40800234?
The molecular weight of AO-081/40800234 is 518.12 g/mol.
Where can I buy AO-081/40800234?
You can request a quote for AO-081/40800234 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-081/40800234?
Yes, KEHONG BIO provides custom synthesis services for AO-081/40800234 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.