AE-848/33588042
TL;DR: AE-848/33588042 (CAS 294654-15-2) is a chemical compound with molecular formula C19H18N2O4 and molecular weight 338.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1H-pyrazol-3-yl]-5-methoxyphenol
Also Known As: AE-848/33588042, 2-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1H-pyrazol-3-yl]-5-methoxyphenol, 2-(4-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-5-methyl-1H-pyrazol-3-yl)-5-methoxyphenol, (6Z)-6-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxycyclohexa-2,4-dien-1-one, 2-(4-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-3-methyl-1H-pyrazol-5-yl)-5-methoxyphenol [M+H]+
| Molecular Formula | C19H18N2O4 |
|---|---|
| Molecular Weight | 338.13 g/mol |
| LogP | 3.53752 |
| Topological Polar Surface Area | 76.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 338.12665 |
| Heavy Atoms | 25 |
| Complexity | 933.1687 |
Chemical Identifiers
| CAS Number | 294654-15-2 |
|---|---|
| SMILES | CC1=C(C(=NN1)C2=C(C=C(C=C2)OC)O)C3=CC4=C(C=C3)OCCO4 |
Product Overview
AE-848/33588042 (CAS 294654-15-2), with molecular formula C19H18N2O4 and molecular weight 338.13 g/mol. IUPAC: 2-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1H-pyrazol-3-yl]-5-methoxyphenol.
Chemical Property Profile of AE-848/33588042
Property Insights of AE-848/33588042
The XLogP value of 3.53752 indicates that AE-848/33588042 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.6 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-848/33588042. Following Lipinski's Rule of Five, AE-848/33588042 has 2 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-848/33588042?
The CAS number of AE-848/33588042 is 294654-15-2.
What is the molecular formula of AE-848/33588042?
The molecular formula of AE-848/33588042 is C19H18N2O4.
What is the molecular weight of AE-848/33588042?
The molecular weight of AE-848/33588042 is 338.13 g/mol.
Where can I buy AE-848/33588042?
You can request a quote for AE-848/33588042 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/33588042?
Yes, KEHONG BIO provides custom synthesis services for AE-848/33588042 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.