![ethyl {2-[({[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}acetyl)amino]-1,3-thiazol-4-yl}acetate structure](/static/products/879/879618-58-3.png)
ethyl {2-[({[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}acetyl)amino]-1,3-thiazol-4-yl}acetate
TL;DR: ethyl {2-[({[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}acetyl)amino]-1,3-thiazol-4-yl}acetate (CAS 879618-58-3) is a chemical compound with molecular formula C20H21N5O4S2 and molecular weight 459.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[2-[[2-[6-amino-1-(3-methylphenyl)-4-oxopyrimidin-2-yl]sulfanylacetyl]amino]-1,3-thiazol-4-yl]acetate
Also Known As: ethyl {2-[({[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}acetyl)amino]-1,3-thiazol-4-yl}acetate, ethyl 2-(2-(2-((6-amino-4-oxo-1-(m-tolyl)-1,4-dihydropyrimidin-2-yl)thio)acetamido)thiazol-4-yl)acetate, ethyl 2-[2-[[2-[6-amino-1-(3-methylphenyl)-4-oxopyrimidin-2-yl]sulfanylacetyl]amino]-1,3-thiazol-4-yl]acetate, ETHYL 2-{2-[(2-{[6-AMINO-1-(3-METHYLPHENYL)-4-OXO-1,4-DIHYDRO-2-PYRIMIDINYL]SULFANYL}ACETYL)AMINO]-1,3-THIAZOL-4-YL}ACETATE
| Molecular Formula | C20H21N5O4S2 |
|---|---|
| Molecular Weight | 459.10 g/mol |
| LogP | 2.41602 |
| Topological Polar Surface Area | 129.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 459.1035 |
| Heavy Atoms | 31 |
| Complexity | 1158.4672 |
Chemical Identifiers
| CAS Number | 879618-58-3 |
|---|---|
| SMILES | CCOC(=O)CC1=CSC(=N1)NC(=O)CSC2=NC(=O)C=C(N2C3=CC=CC(=C3)C)N |
Product Overview
ethyl {2-[({[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}acetyl)amino]-1,3-thiazol-4-yl}acetate (CAS 879618-58-3), with molecular formula C20H21N5O4S2 and molecular weight 459.10 g/mol. IUPAC: ethyl 2-[2-[[2-[6-amino-1-(3-methylphenyl)-4-oxopyrimidin-2-yl]sulfanylacetyl]amino]-1,3-thiazol-4-yl]acetate.
Chemical Property Profile of ethyl {2-[({[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}acetyl)amino]-1,3-thiazol-4-yl}acetate
Property Insights of ethyl {2-[({[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}acetyl)amino]-1,3-thiazol-4-yl}acetate
The XLogP value of 2.41602 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl {2-[({[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}acetyl)amino]-1,3-thiazol-4-yl}acetate. The TPSA of 129.2 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl {2-[({[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}acetyl)amino]-1,3-thiazol-4-yl}acetate. Following Lipinski's Rule of Five, ethyl {2-[({[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}acetyl)amino]-1,3-thiazol-4-yl}acetate has 2 hydrogen bond donor(s) and 9 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 ethyl {2-[({[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}acetyl)amino]-1,3-thiazol-4-yl}acetate?
The CAS number of ethyl {2-[({[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}acetyl)amino]-1,3-thiazol-4-yl}acetate is 879618-58-3.
What is the molecular formula of ethyl {2-[({[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}acetyl)amino]-1,3-thiazol-4-yl}acetate?
The molecular formula of ethyl {2-[({[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}acetyl)amino]-1,3-thiazol-4-yl}acetate is C20H21N5O4S2.
What is the molecular weight of ethyl {2-[({[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}acetyl)amino]-1,3-thiazol-4-yl}acetate?
The molecular weight of ethyl {2-[({[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}acetyl)amino]-1,3-thiazol-4-yl}acetate is 459.10 g/mol.
Where can I buy ethyl {2-[({[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}acetyl)amino]-1,3-thiazol-4-yl}acetate?
You can request a quote for ethyl {2-[({[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}acetyl)amino]-1,3-thiazol-4-yl}acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl {2-[({[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}acetyl)amino]-1,3-thiazol-4-yl}acetate?
Yes, KEHONG BIO provides custom synthesis services for ethyl {2-[({[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}acetyl)amino]-1,3-thiazol-4-yl}acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.