AO-299/15047046
TL;DR: AO-299/15047046 (CAS 361198-87-0) is a chemical compound with molecular formula C19H15ClN4O2S2 and molecular weight 430.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6Z)-6-[[5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-5-imino-2-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Also Known As: AO-299/15047046, 6-({5-[(4-chlorophenyl)sulfanyl]-2-furyl}methylene)-5-imino-2-propyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, (6Z)-6-[[5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-5-imino-2-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, (6Z)-6-({5-[(4-CHLOROPHENYL)SULFANYL]FURAN-2-YL}METHYLIDENE)-5-IMINO-2-PROPYL-5H,6H,7H-[1,3,4]THIADIAZOLO[3,2-A]PYRIMIDIN-7-ONE, (Z)-6-((5-((4-chlorophenyl)thio)furan-2-yl)methylene)-5-imino-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one
| Molecular Formula | C19H15ClN4O2S2 |
|---|---|
| Molecular Weight | 430.03 g/mol |
| LogP | 5.50347 |
| Topological Polar Surface Area | 82.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 430.0325 |
| Heavy Atoms | 28 |
| Complexity | 1040.458 |
Chemical Identifiers
| CAS Number | 361198-87-0 |
|---|---|
| SMILES | CCCC1=NN2C(=N)/C(=C/C3=CC=C(O3)SC4=CC=C(C=C4)Cl)/C(=O)N=C2S1 |
Product Overview
AO-299/15047046 (CAS 361198-87-0), with molecular formula C19H15ClN4O2S2 and molecular weight 430.03 g/mol. IUPAC: (6Z)-6-[[5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-5-imino-2-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one.
Chemical Property Profile of AO-299/15047046
Property Insights of AO-299/15047046
The XLogP value of 5.50347 indicates that AO-299/15047046 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-299/15047046. Following Lipinski's Rule of Five, AO-299/15047046 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AO-299/15047046?
The CAS number of AO-299/15047046 is 361198-87-0.
What is the molecular formula of AO-299/15047046?
The molecular formula of AO-299/15047046 is C19H15ClN4O2S2.
What is the molecular weight of AO-299/15047046?
The molecular weight of AO-299/15047046 is 430.03 g/mol.
Where can I buy AO-299/15047046?
You can request a quote for AO-299/15047046 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-299/15047046?
Yes, KEHONG BIO provides custom synthesis services for AO-299/15047046 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.