AO-081/15245172
TL;DR: AO-081/15245172 (CAS 495402-78-3) is a chemical compound with molecular formula C26H20Cl2N2O4 and molecular weight 494.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,10-bis(3-chloro-4-methylphenyl)-4,10-diazatetracyclo[5.5.2.02,6.08,12]tetradec-13-ene-3,5,9,11-tetrone
Also Known As: AO-081/15245172, 2,6-bis(3-chloro-4-methylphenyl)-4,4a,8,8a-tetrahydro-4,8-ethenopyrrolo[3,4-f]isoindole-1,3,5,7(2H,3aH,6H,7aH)-tetraone, 4,10-bis(3-chloro-4-methylphenyl)-4,10-diazatetracyclo[5.5.2.0~2,6~.0~8,12~]tetradec-13-ene-3,5,9,11-tetrone, 4,10-Bis(3-chloro-4-methylphenyl)-4,10-diazatetracyclo[5.5.2.02,6.08,12]tetradec-13-ene-3,5,9,11-tetrone
| Molecular Formula | C26H20Cl2N2O4 |
|---|---|
| Molecular Weight | 494.08 g/mol |
| LogP | 4.33744 |
| Topological Polar Surface Area | 74.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 494.08002 |
| Heavy Atoms | 34 |
| Complexity | 1206.8062 |
Chemical Identifiers
| CAS Number | 495402-78-3 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N2C(=O)C3C4C=CC(C3C2=O)C5C4C(=O)N(C5=O)C6=CC(=C(C=C6)C)Cl)Cl |
Product Overview
AO-081/15245172 (CAS 495402-78-3), with molecular formula C26H20Cl2N2O4 and molecular weight 494.08 g/mol. IUPAC: 4,10-bis(3-chloro-4-methylphenyl)-4,10-diazatetracyclo[5.5.2.02,6.08,12]tetradec-13-ene-3,5,9,11-tetrone.
Chemical Property Profile of AO-081/15245172
Property Insights of AO-081/15245172
The XLogP value of 4.33744 indicates that AO-081/15245172 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.76 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-081/15245172. Following Lipinski's Rule of Five, AO-081/15245172 has 0 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 AO-081/15245172?
The CAS number of AO-081/15245172 is 495402-78-3.
What is the molecular formula of AO-081/15245172?
The molecular formula of AO-081/15245172 is C26H20Cl2N2O4.
What is the molecular weight of AO-081/15245172?
The molecular weight of AO-081/15245172 is 494.08 g/mol.
Where can I buy AO-081/15245172?
You can request a quote for AO-081/15245172 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-081/15245172?
Yes, KEHONG BIO provides custom synthesis services for AO-081/15245172 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.