AE-848/36501035
TL;DR: AE-848/36501035 (CAS 1164539-77-8) is a chemical compound with molecular formula C25H20ClN3O3 and molecular weight 445.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[[4-(dimethylamino)phenyl]iminomethyl]-2-phenyl-1,3-oxazol-5-yl] 3-chlorobenzoate
Also Known As: AE-848/36501035, 4-({[4-(DIMETHYLAMINO)PHENYL]IMINO}METHYL)-2-PHENYL-1,3-OXAZOL-5-YL 3-CHLOROBENZOATE, (E)-4-(((4-(dimethylamino)phenyl)imino)methyl)-2-phenyloxazol-5-yl 3-chlorobenzoate, [4-[(4-dimethylaminophenyl)iminomethyl]-2-phenyl-1,3-oxazol-5-yl] 3-chlorobenzoate, 4-[(E)-{[4-(dimethylamino)phenyl]imino}methyl]-2-phenyl-1,3-oxazol-5-yl 3-chlorobenzoate
| Molecular Formula | C25H20ClN3O3 |
|---|---|
| Molecular Weight | 445.12 g/mol |
| LogP | 6.0308 |
| Topological Polar Surface Area | 67.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 445.11932 |
| Heavy Atoms | 32 |
| Complexity | 1249.1844 |
Chemical Identifiers
| CAS Number | 1164539-77-8 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)N=CC2=C(OC(=N2)C3=CC=CC=C3)OC(=O)C4=CC(=CC=C4)Cl |
Product Overview
AE-848/36501035 (CAS 1164539-77-8), with molecular formula C25H20ClN3O3 and molecular weight 445.12 g/mol. IUPAC: [4-[[4-(dimethylamino)phenyl]iminomethyl]-2-phenyl-1,3-oxazol-5-yl] 3-chlorobenzoate.
Chemical Property Profile of AE-848/36501035
Property Insights of AE-848/36501035
The XLogP value of 6.0308 indicates that AE-848/36501035 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.93 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-848/36501035. Following Lipinski's Rule of Five, AE-848/36501035 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AE-848/36501035?
The CAS number of AE-848/36501035 is 1164539-77-8.
What is the molecular formula of AE-848/36501035?
The molecular formula of AE-848/36501035 is C25H20ClN3O3.
What is the molecular weight of AE-848/36501035?
The molecular weight of AE-848/36501035 is 445.12 g/mol.
Where can I buy AE-848/36501035?
You can request a quote for AE-848/36501035 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/36501035?
Yes, KEHONG BIO provides custom synthesis services for AE-848/36501035 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.