AE-848/15341500
TL;DR: AE-848/15341500 (CAS 380651-41-2) is a chemical compound with molecular formula C24H21FN2O5 and molecular weight 436.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[6,7-dimethoxy-1-(3-nitrophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]-(4-fluorophenyl)methanone
Also Known As: AE-848/15341500, [6,7-dimethoxy-1-(3-nitrophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]-(4-fluorophenyl)methanone, 2-(4-fluorobenzoyl)-6,7-dimethoxy-1-(3-nitrophenyl)-1,2,3,4-tetrahydroisoquinoline, 2-(4-fluorobenzoyl)-1-{3-nitrophenyl}-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline, REGID_for_CID_2897020
| Molecular Formula | C24H21FN2O5 |
|---|---|
| Molecular Weight | 436.14 g/mol |
| LogP | 4.539 |
| Topological Polar Surface Area | 81.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 436.14346 |
| Heavy Atoms | 32 |
| Complexity | 1179.5071 |
Chemical Identifiers
| CAS Number | 380651-41-2 |
|---|---|
| SMILES | COC1=C(C=C2C(N(CCC2=C1)C(=O)C3=CC=C(C=C3)F)C4=CC(=CC=C4)[N+](=O)[O-])OC |
Product Overview
AE-848/15341500 (CAS 380651-41-2), with molecular formula C24H21FN2O5 and molecular weight 436.14 g/mol. IUPAC: [6,7-dimethoxy-1-(3-nitrophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]-(4-fluorophenyl)methanone.
Chemical Property Profile of AE-848/15341500
Property Insights of AE-848/15341500
The XLogP value of 4.539 indicates that AE-848/15341500 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.91 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-848/15341500. Following Lipinski's Rule of Five, AE-848/15341500 has 0 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-848/15341500?
The CAS number of AE-848/15341500 is 380651-41-2.
What is the molecular formula of AE-848/15341500?
The molecular formula of AE-848/15341500 is C24H21FN2O5.
What is the molecular weight of AE-848/15341500?
The molecular weight of AE-848/15341500 is 436.14 g/mol.
Where can I buy AE-848/15341500?
You can request a quote for AE-848/15341500 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/15341500?
Yes, KEHONG BIO provides custom synthesis services for AE-848/15341500 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.