AO-299/15048181
TL;DR: AO-299/15048181 (CAS 5826-58-4) is a chemical compound with molecular formula C23H23ClN4O2S and molecular weight 454.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[[5-(2-chlorophenyl)furan-2-yl]methylidene]-2-heptyl-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Also Known As: AO-299/15048181, 6-[[5-(2-chlorophenyl)furan-2-yl]methylidene]-2-heptyl-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-{[5-(2-Chlorophenyl)furan-2-yl]methylidene}-2-heptyl-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
| Molecular Formula | C23H23ClN4O2S |
|---|---|
| Molecular Weight | 454.12 g/mol |
| LogP | 6.57967 |
| Topological Polar Surface Area | 82.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 454.12302 |
| Heavy Atoms | 31 |
| Complexity | 1102.501 |
Chemical Identifiers
| CAS Number | 5826-58-4 |
|---|---|
| SMILES | CCCCCCCC1=NN2C(=N)C(=CC3=CC=C(O3)C4=CC=CC=C4Cl)C(=O)N=C2S1 |
Product Overview
AO-299/15048181 (CAS 5826-58-4), with molecular formula C23H23ClN4O2S and molecular weight 454.12 g/mol. IUPAC: 6-[[5-(2-chlorophenyl)furan-2-yl]methylidene]-2-heptyl-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one.
Chemical Property Profile of AO-299/15048181
Property Insights of AO-299/15048181
The XLogP value of 6.57967 indicates that AO-299/15048181 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.02 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-299/15048181. Following Lipinski's Rule of Five, AO-299/15048181 has 1 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 AO-299/15048181?
The CAS number of AO-299/15048181 is 5826-58-4.
What is the molecular formula of AO-299/15048181?
The molecular formula of AO-299/15048181 is C23H23ClN4O2S.
What is the molecular weight of AO-299/15048181?
The molecular weight of AO-299/15048181 is 454.12 g/mol.
Where can I buy AO-299/15048181?
You can request a quote for AO-299/15048181 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-299/15048181?
Yes, KEHONG BIO provides custom synthesis services for AO-299/15048181 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.