AE-848/32606016
TL;DR: AE-848/32606016 (CAS 351063-19-9) is a chemical compound with molecular formula C19H18N2O3S and molecular weight 354.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(4-hydroxyphenyl)-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: AE-848/32606016, F1038-0237, A3021/0127392, ethyl 4-(4-hydroxyphenyl)-6-phenyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate, ethyl 4-(4-hydroxyphenyl)-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
| Molecular Formula | C19H18N2O3S |
|---|---|
| Molecular Weight | 354.10 g/mol |
| LogP | 2.8854 |
| Topological Polar Surface Area | 70.59 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 354.10382 |
| Heavy Atoms | 25 |
| Complexity | 816.3227 |
Chemical Identifiers
| CAS Number | 351063-19-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=S)NC1C2=CC=C(C=C2)O)C3=CC=CC=C3 |
Product Overview
AE-848/32606016 (CAS 351063-19-9), with molecular formula C19H18N2O3S and molecular weight 354.10 g/mol. IUPAC: ethyl 4-(4-hydroxyphenyl)-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of AE-848/32606016
Property Insights of AE-848/32606016
The XLogP value of 2.8854 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AE-848/32606016. The TPSA of 70.59 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-848/32606016. Following Lipinski's Rule of Five, AE-848/32606016 has 3 hydrogen bond donor(s) and 4 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-848/32606016?
The CAS number of AE-848/32606016 is 351063-19-9.
What is the molecular formula of AE-848/32606016?
The molecular formula of AE-848/32606016 is C19H18N2O3S.
What is the molecular weight of AE-848/32606016?
The molecular weight of AE-848/32606016 is 354.10 g/mol.
Where can I buy AE-848/32606016?
You can request a quote for AE-848/32606016 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/32606016?
Yes, KEHONG BIO provides custom synthesis services for AE-848/32606016 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.