AO-022/43452721
TL;DR: AO-022/43452721 (CAS 839701-85-8) is a chemical compound with molecular formula C19H22N2O3S2 and molecular weight 390.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 2,7-dimethyl-5-(4-methylsulfanylphenyl)-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: AO-022/43452721, isopropyl 2,7-dimethyl-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, propan-2-yl 2,7-dimethyl-5-(4-methylsulfanylphenyl)-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, isopropyl 2,7-dimethyl-5-(4-(methylthio)phenyl)-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate, propan-2-yl 2,7-dimethyl-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
| Molecular Formula | C19H22N2O3S2 |
|---|---|
| Molecular Weight | 390.11 g/mol |
| LogP | 4.0087 |
| Topological Polar Surface Area | 58.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 390.10718 |
| Heavy Atoms | 26 |
| Complexity | 799.5072 |
Chemical Identifiers
| CAS Number | 839701-85-8 |
|---|---|
| SMILES | CC1C(=O)N2C(C(=C(N=C2S1)C)C(=O)OC(C)C)C3=CC=C(C=C3)SC |
Product Overview
AO-022/43452721 (CAS 839701-85-8), with molecular formula C19H22N2O3S2 and molecular weight 390.11 g/mol. IUPAC: propan-2-yl 2,7-dimethyl-5-(4-methylsulfanylphenyl)-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of AO-022/43452721
Property Insights of AO-022/43452721
The XLogP value of 4.0087 indicates that AO-022/43452721 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.97 Ų, AO-022/43452721 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AO-022/43452721 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AO-022/43452721?
The CAS number of AO-022/43452721 is 839701-85-8.
What is the molecular formula of AO-022/43452721?
The molecular formula of AO-022/43452721 is C19H22N2O3S2.
What is the molecular weight of AO-022/43452721?
The molecular weight of AO-022/43452721 is 390.11 g/mol.
Where can I buy AO-022/43452721?
You can request a quote for AO-022/43452721 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43452721?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43452721 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.