AO-299/15048301
TL;DR: AO-299/15048301 (CAS 361200-86-4) is a chemical compound with molecular formula C23H20ClFN4O3S and molecular weight 486.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6Z)-6-[[3-chloro-4-[(4-fluorophenyl)methoxy]-5-methoxyphenyl]methylidene]-5-imino-2-propan-2-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Also Known As: AO-299/15048301, (6Z)-6-[[3-chloro-4-[(4-fluorophenyl)methoxy]-5-methoxyphenyl]methylidene]-5-imino-2-propan-2-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-{3-chloro-4-[(4-fluorobenzyl)oxy]-5-methoxybenzylidene}-5-imino-2-isopropyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, (6Z)-6-({3-CHLORO-4-[(4-FLUOROPHENYL)METHOXY]-5-METHOXYPHENYL}METHYLIDENE)-5-IMINO-2-(PROPAN-2-YL)-5H,6H,7H-[1,3,4]THIADIAZOLO[3,2-A]PYRIMIDIN-7-ONE, (6Z)-6-{3-chloro-4-[(4-fluorobenzyl)oxy]-5-methoxybenzylidene}-5-imino-2-(propan-2-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
| Molecular Formula | C23H20ClFN4O3S |
|---|---|
| Molecular Weight | 486.09 g/mol |
| LogP | 5.34187 |
| Topological Polar Surface Area | 87.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 486.09286 |
| Heavy Atoms | 33 |
| Complexity | 1224.9575 |
Chemical Identifiers
| CAS Number | 361200-86-4 |
|---|---|
| SMILES | CC(C)C1=NN2C(=N)/C(=C/C3=CC(=C(C(=C3)Cl)OCC4=CC=C(C=C4)F)OC)/C(=O)N=C2S1 |
Product Overview
AO-299/15048301 (CAS 361200-86-4), with molecular formula C23H20ClFN4O3S and molecular weight 486.09 g/mol. IUPAC: (6Z)-6-[[3-chloro-4-[(4-fluorophenyl)methoxy]-5-methoxyphenyl]methylidene]-5-imino-2-propan-2-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one.
Chemical Property Profile of AO-299/15048301
Property Insights of AO-299/15048301
The XLogP value of 5.34187 indicates that AO-299/15048301 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.34 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-299/15048301. Following Lipinski's Rule of Five, AO-299/15048301 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-299/15048301?
The CAS number of AO-299/15048301 is 361200-86-4.
What is the molecular formula of AO-299/15048301?
The molecular formula of AO-299/15048301 is C23H20ClFN4O3S.
What is the molecular weight of AO-299/15048301?
The molecular weight of AO-299/15048301 is 486.09 g/mol.
Where can I buy AO-299/15048301?
You can request a quote for AO-299/15048301 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-299/15048301?
Yes, KEHONG BIO provides custom synthesis services for AO-299/15048301 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.