AE-848/33208021
TL;DR: AE-848/33208021 (CAS 393847-12-6) is a chemical compound with molecular formula C30H42N4O2 and molecular weight 490.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,5-ditert-butyl-4-hydroxyphenyl)-2-[2-imino-3-(2-piperidin-1-ylethyl)benzimidazol-1-yl]ethanone
Also Known As: AE-848/33208021, J1.633.752H, 1-(3,5-ditert-butyl-4-hydroxyphenyl)-2-[2-imino-3-(2-piperidin-1-ylethyl)benzimidazol-1-yl]ethanone, 1-(3,5-Di-tert-butyl-4-hydroxy-phenyl)-2-[2-imino-3-(2-piperidin-1-yl-ethyl)-2,3-dihydro-benzoimidazol-1-yl]-ethanone, 1-(3,5-di-tert-butyl-4-hydroxyphenyl)-2-{2-imino-3-[2-(piperidin-1-yl)ethyl]-2,3-dihydro-1H-1,3-benzodiazol-1-yl}ethan-1-one
| Molecular Formula | C30H42N4O2 |
|---|---|
| Molecular Weight | 490.33 g/mol |
| LogP | 5.59167 |
| Topological Polar Surface Area | 74.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 490.33078 |
| Heavy Atoms | 36 |
| Complexity | 1276.4332 |
Chemical Identifiers
| CAS Number | 393847-12-6 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)CN2C3=CC=CC=C3N(C2=N)CCN4CCCCC4 |
Product Overview
AE-848/33208021 (CAS 393847-12-6), with molecular formula C30H42N4O2 and molecular weight 490.33 g/mol. IUPAC: 1-(3,5-ditert-butyl-4-hydroxyphenyl)-2-[2-imino-3-(2-piperidin-1-ylethyl)benzimidazol-1-yl]ethanone.
Chemical Property Profile of AE-848/33208021
Property Insights of AE-848/33208021
The XLogP value of 5.59167 indicates that AE-848/33208021 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.25 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-848/33208021. Following Lipinski's Rule of Five, AE-848/33208021 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AE-848/33208021?
The CAS number of AE-848/33208021 is 393847-12-6.
What is the molecular formula of AE-848/33208021?
The molecular formula of AE-848/33208021 is C30H42N4O2.
What is the molecular weight of AE-848/33208021?
The molecular weight of AE-848/33208021 is 490.33 g/mol.
Where can I buy AE-848/33208021?
You can request a quote for AE-848/33208021 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/33208021?
Yes, KEHONG BIO provides custom synthesis services for AE-848/33208021 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.