AE-848/08416037
TL;DR: AE-848/08416037 (CAS 321945-63-5) is a chemical compound with molecular formula C25H17N3O5 and molecular weight 439.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl)-3-nitrobenzamide
Also Known As: AE-848/08416037, N-(16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)-3-nitrobenzamide (non-preferred name), N-(12,14-dioxo-11,12,14,15-tetrahydro-9H-9,10-[3,4]epipyrroloanthracen-13(10H)-yl)-3-nitrobenzamide, N-(16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)-3-nitrobenzamide, N~1~-(16,18-DIOXO-17-AZAPENTACYCLO[6.6.5.0~2,7~.0~9,14~.0~15,19~]NONADECA-2,4,6,9,11,13-HEXAEN-17-YL)-3-NITROBENZAMIDE
| Molecular Formula | C25H17N3O5 |
|---|---|
| Molecular Weight | 439.12 g/mol |
| LogP | 3.1318 |
| Topological Polar Surface Area | 109.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 439.11682 |
| Heavy Atoms | 33 |
| Complexity | 1268.2152 |
Chemical Identifiers
| CAS Number | 321945-63-5 |
|---|---|
| SMILES | C1=CC=C2C3C4C(C(C2=C1)C5=CC=CC=C35)C(=O)N(C4=O)NC(=O)C6=CC(=CC=C6)[N+](=O)[O-] |
Product Overview
AE-848/08416037 (CAS 321945-63-5), with molecular formula C25H17N3O5 and molecular weight 439.12 g/mol. IUPAC: N-(16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl)-3-nitrobenzamide.
Chemical Property Profile of AE-848/08416037
Property Insights of AE-848/08416037
The XLogP value of 3.1318 indicates that AE-848/08416037 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.62 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-848/08416037. Following Lipinski's Rule of Five, AE-848/08416037 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 AE-848/08416037?
The CAS number of AE-848/08416037 is 321945-63-5.
What is the molecular formula of AE-848/08416037?
The molecular formula of AE-848/08416037 is C25H17N3O5.
What is the molecular weight of AE-848/08416037?
The molecular weight of AE-848/08416037 is 439.12 g/mol.
Where can I buy AE-848/08416037?
You can request a quote for AE-848/08416037 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/08416037?
Yes, KEHONG BIO provides custom synthesis services for AE-848/08416037 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.