AL-281/11335228
TL;DR: AL-281/11335228 (CAS 330179-66-3) is a chemical compound with molecular formula C26H25N3OS2 and molecular weight 459.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,11-dibenzyl-5-prop-2-enylsulfanyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Also Known As: AL-281/11335228, 2-(allylthio)-3,7-dibenzyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one, 2-(allylsulfanyl)-3,7-dibenzyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one, 3,7-dibenzyl-2-(prop-2-en-1-ylsulfanyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
| Molecular Formula | C26H25N3OS2 |
|---|---|
| Molecular Weight | 459.14 g/mol |
| LogP | 5.3427 |
| Topological Polar Surface Area | 38.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 459.1439 |
| Heavy Atoms | 32 |
| Complexity | 1295.6538 |
Chemical Identifiers
| CAS Number | 330179-66-3 |
|---|---|
| SMILES | C=CCSC1=NC2=C(C3=C(S2)CN(CC3)CC4=CC=CC=C4)C(=O)N1CC5=CC=CC=C5 |
Product Overview
AL-281/11335228 (CAS 330179-66-3), with molecular formula C26H25N3OS2 and molecular weight 459.14 g/mol. IUPAC: 4,11-dibenzyl-5-prop-2-enylsulfanyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one.
Chemical Property Profile of AL-281/11335228
Property Insights of AL-281/11335228
The XLogP value of 5.3427 indicates that AL-281/11335228 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.13 Ų, AL-281/11335228 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AL-281/11335228 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 AL-281/11335228?
The CAS number of AL-281/11335228 is 330179-66-3.
What is the molecular formula of AL-281/11335228?
The molecular formula of AL-281/11335228 is C26H25N3OS2.
What is the molecular weight of AL-281/11335228?
The molecular weight of AL-281/11335228 is 459.14 g/mol.
Where can I buy AL-281/11335228?
You can request a quote for AL-281/11335228 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AL-281/11335228?
Yes, KEHONG BIO provides custom synthesis services for AL-281/11335228 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.