AO-299/15047127
TL;DR: AO-299/15047127 (CAS 5824-14-6) is a chemical compound with molecular formula C31H33N5O2S and molecular weight 539.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[[1-[2-(4-cyclohexylphenoxy)ethyl]indol-3-yl]methylidene]-5-imino-2-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Also Known As: AO-299/15047127, 1-Methyl-2-Chlor--, currency1-5, A-androstenol-(17, A)-on-(3)
| Molecular Formula | C31H33N5O2S |
|---|---|
| Molecular Weight | 539.24 g/mol |
| LogP | 7.18727 |
| Topological Polar Surface Area | 83.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 539.2355 |
| Heavy Atoms | 39 |
| Complexity | 1494.9093 |
Chemical Identifiers
| CAS Number | 5824-14-6 |
|---|---|
| SMILES | CCCC1=NN2C(=N)C(=CC3=CN(C4=CC=CC=C43)CCOC5=CC=C(C=C5)C6CCCCC6)C(=O)N=C2S1 |
Product Overview
AO-299/15047127 (CAS 5824-14-6), with molecular formula C31H33N5O2S and molecular weight 539.24 g/mol. IUPAC: 6-[[1-[2-(4-cyclohexylphenoxy)ethyl]indol-3-yl]methylidene]-5-imino-2-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one.
Chemical Property Profile of AO-299/15047127
Property Insights of AO-299/15047127
The XLogP value of 7.18727 indicates that AO-299/15047127 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.04 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-299/15047127. Following Lipinski's Rule of Five, AO-299/15047127 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-299/15047127?
The CAS number of AO-299/15047127 is 5824-14-6.
What is the molecular formula of AO-299/15047127?
The molecular formula of AO-299/15047127 is C31H33N5O2S.
What is the molecular weight of AO-299/15047127?
The molecular weight of AO-299/15047127 is 539.24 g/mol.
Where can I buy AO-299/15047127?
You can request a quote for AO-299/15047127 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-299/15047127?
Yes, KEHONG BIO provides custom synthesis services for AO-299/15047127 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.