AE-848/15341006
TL;DR: AE-848/15341006 (CAS 351159-76-7) is a chemical compound with molecular formula C25H24N2O2S2 and molecular weight 448.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-benzylsulfanyl-4-(4-methoxyphenyl)-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one
Also Known As: AE-848/15341006, 2-(benzylsulfanyl)-3-(4-methoxyphenyl)-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one, 2-benzylsulfanyl-3-(4-methoxyphenyl)-6,7,8,9-tetrahydro-5H-cyclohepta[2,3]thieno[2,4-b]pyrimidin-4-one, 5-Benzylsulfanyl-4-(4-methoxyphenyl)-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one, 2-(benzylthio)-3-(4-methoxyphenyl)-6,7,8,9-tetrahydro-3H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4(5H)-one
| Molecular Formula | C25H24N2O2S2 |
|---|---|
| Molecular Weight | 448.13 g/mol |
| LogP | 6.017 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 448.12793 |
| Heavy Atoms | 31 |
| Complexity | 1260.9169 |
Chemical Identifiers
| CAS Number | 351159-76-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC4=CC=CC=C4)SC5=C3CCCCC5 |
Product Overview
AE-848/15341006 (CAS 351159-76-7), with molecular formula C25H24N2O2S2 and molecular weight 448.13 g/mol. IUPAC: 5-benzylsulfanyl-4-(4-methoxyphenyl)-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one.
Chemical Property Profile of AE-848/15341006
Property Insights of AE-848/15341006
The XLogP value of 6.017 indicates that AE-848/15341006 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.12 Ų, AE-848/15341006 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AE-848/15341006 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AE-848/15341006?
The CAS number of AE-848/15341006 is 351159-76-7.
What is the molecular formula of AE-848/15341006?
The molecular formula of AE-848/15341006 is C25H24N2O2S2.
What is the molecular weight of AE-848/15341006?
The molecular weight of AE-848/15341006 is 448.13 g/mol.
Where can I buy AE-848/15341006?
You can request a quote for AE-848/15341006 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/15341006?
Yes, KEHONG BIO provides custom synthesis services for AE-848/15341006 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.