AJ-292/15367100
TL;DR: AJ-292/15367100 (CAS 6449-86-1) is a chemical compound with molecular formula C25H24BrN3OS2 and molecular weight 525.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-bromophenyl)methylsulfanyl]-4-phenyl-11-propyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Also Known As: AJ-292/15367100, 2-[(4-bromobenzyl)sulfanyl]-3-phenyl-7-propyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one, 5-[(4-Bromophenyl)methylsulfanyl]-4-phenyl-11-propyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one, 2-{[(4-Bromophenyl)methyl]sulfanyl}-3-phenyl-7-propyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
| Molecular Formula | C25H24BrN3OS2 |
|---|---|
| Molecular Weight | 525.05 g/mol |
| LogP | 6.2701 |
| Topological Polar Surface Area | 38.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 525.05444 |
| Heavy Atoms | 32 |
| Complexity | 1299.0139 |
Chemical Identifiers
| CAS Number | 6449-86-1 |
|---|---|
| SMILES | CCCN1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC4=CC=C(C=C4)Br)C5=CC=CC=C5 |
Product Overview
AJ-292/15367100 (CAS 6449-86-1), with molecular formula C25H24BrN3OS2 and molecular weight 525.05 g/mol. IUPAC: 5-[(4-bromophenyl)methylsulfanyl]-4-phenyl-11-propyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one.
Chemical Property Profile of AJ-292/15367100
Property Insights of AJ-292/15367100
The XLogP value of 6.2701 indicates that AJ-292/15367100 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.13 Ų, AJ-292/15367100 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AJ-292/15367100 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 AJ-292/15367100?
The CAS number of AJ-292/15367100 is 6449-86-1.
What is the molecular formula of AJ-292/15367100?
The molecular formula of AJ-292/15367100 is C25H24BrN3OS2.
What is the molecular weight of AJ-292/15367100?
The molecular weight of AJ-292/15367100 is 525.05 g/mol.
Where can I buy AJ-292/15367100?
You can request a quote for AJ-292/15367100 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AJ-292/15367100?
Yes, KEHONG BIO provides custom synthesis services for AJ-292/15367100 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.