AO-081/15572477
TL;DR: AO-081/15572477 (CAS 495384-48-0) is a chemical compound with molecular formula C28H27N3O4 and molecular weight 469.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,7-bis(4-methoxyphenyl)-2-phenyl-1,4,8-triazatricyclo[6.3.0.02,6]undecane-3,5-dione
Also Known As: AO-081/15572477, 2,9-bis(4-methoxyphenyl)-3a-phenyl-perhydropyrazolo[1,2-a]pyrrolo[3,4-c]pyrazole-1,3-dione, 4,7-bis(4-methoxyphenyl)-2-phenyl-1,4,8-triazatricyclo[6.3.0.02,6]undecane-3,5-dione, 2,9-bis(4-methoxyphenyl)-3a-phenylhexahydro-1H-pyrazolo[1,2-a]pyrrolo[3,4-c]pyrazole-1,3(2H)-dione, 2,9-bis(4-methoxyphenyl)-3a-phenyltetrahydro-5H-pyrazolo[1,2-a]pyrrolo[3,4-c]pyrazole-1,3(2H,3aH)-dione
| Molecular Formula | C28H27N3O4 |
|---|---|
| Molecular Weight | 469.20 g/mol |
| LogP | 3.7663 |
| Topological Polar Surface Area | 62.32 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 469.20016 |
| Heavy Atoms | 35 |
| Complexity | 1261.6246 |
Chemical Identifiers
| CAS Number | 495384-48-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2C3C(=O)N(C(=O)C3(N4N2CCC4)C5=CC=CC=C5)C6=CC=C(C=C6)OC |
Product Overview
AO-081/15572477 (CAS 495384-48-0), with molecular formula C28H27N3O4 and molecular weight 469.20 g/mol. IUPAC: 4,7-bis(4-methoxyphenyl)-2-phenyl-1,4,8-triazatricyclo[6.3.0.02,6]undecane-3,5-dione.
Chemical Property Profile of AO-081/15572477
Property Insights of AO-081/15572477
The XLogP value of 3.7663 indicates that AO-081/15572477 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.32 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-081/15572477. Following Lipinski's Rule of Five, AO-081/15572477 has 0 hydrogen bond donor(s) and 6 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-081/15572477?
The CAS number of AO-081/15572477 is 495384-48-0.
What is the molecular formula of AO-081/15572477?
The molecular formula of AO-081/15572477 is C28H27N3O4.
What is the molecular weight of AO-081/15572477?
The molecular weight of AO-081/15572477 is 469.20 g/mol.
Where can I buy AO-081/15572477?
You can request a quote for AO-081/15572477 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-081/15572477?
Yes, KEHONG BIO provides custom synthesis services for AO-081/15572477 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.