AE-641/09779055
TL;DR: AE-641/09779055 (CAS 1024249-64-6) is a chemical compound with molecular formula C30H24N2O5 and molecular weight 492.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-7-methyl-4-(3-nitrophenyl)-8,9-diphenyl-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5,10-trione
Also Known As: AE-641/09779055, 1-Ethyl-7-methyl-4-(3-nitrophenyl)-8,9-diphenyl-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5,10-trione, 1-ethyl-4-{3-nitrophenyl}-7-methyl-8,9-diphenyl-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3,5,10-trione, 4-Ethyl-7-methyl-2-(3-nitrophenyl)-5,6-diphenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione, 7-ethyl-1-methyl-4-(3-nitrophenyl)-8,9-diphenyl-4-azatricyclo[5.2.1.0<2,6>]dec -8-ene-3,5,10-trione
| Molecular Formula | C30H24N2O5 |
|---|---|
| Molecular Weight | 492.17 g/mol |
| LogP | 5.3104 |
| Topological Polar Surface Area | 97.59 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 492.16852 |
| Heavy Atoms | 37 |
| Complexity | 1529.7861 |
Chemical Identifiers
| CAS Number | 1024249-64-6 |
|---|---|
| SMILES | CCC12C3C(C(=O)N(C3=O)C4=CC(=CC=C4)[N+](=O)[O-])C(C1=O)(C(=C2C5=CC=CC=C5)C6=CC=CC=C6)C |
Product Overview
AE-641/09779055 (CAS 1024249-64-6), with molecular formula C30H24N2O5 and molecular weight 492.17 g/mol. IUPAC: 1-ethyl-7-methyl-4-(3-nitrophenyl)-8,9-diphenyl-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5,10-trione.
Chemical Property Profile of AE-641/09779055
Property Insights of AE-641/09779055
The XLogP value of 5.3104 indicates that AE-641/09779055 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.59 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-641/09779055. Following Lipinski's Rule of Five, AE-641/09779055 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AE-641/09779055?
The CAS number of AE-641/09779055 is 1024249-64-6.
What is the molecular formula of AE-641/09779055?
The molecular formula of AE-641/09779055 is C30H24N2O5.
What is the molecular weight of AE-641/09779055?
The molecular weight of AE-641/09779055 is 492.17 g/mol.
Where can I buy AE-641/09779055?
You can request a quote for AE-641/09779055 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-641/09779055?
Yes, KEHONG BIO provides custom synthesis services for AE-641/09779055 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.