![Ethyl 2-{[2-(dimethylamino)-5-methoxy-4-pyrimidinyl]sulfanyl}acetate structure](/static/products/4000/400084-01-7.webp)
Ethyl 2-{[2-(dimethylamino)-5-methoxy-4-pyrimidinyl]sulfanyl}acetate
TL;DR: Ethyl 2-{[2-(dimethylamino)-5-methoxy-4-pyrimidinyl]sulfanyl}acetate (CAS 400084-01-7) is a chemical compound with molecular formula C11H17N3O3S and molecular weight 271.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[2-(dimethylamino)-5-methoxypyrimidin-4-yl]sulfanylacetate
Also Known As: 5J-350S, ethyl 2-{[2-(dimethylamino)-5-methoxy-4-pyrimidinyl]sulfanyl}acetate, ethyl 2-[2-(dimethylamino)-5-methoxypyrimidin-4-yl]sulfanylacetate, ethyl 2-{[2-(dimethylamino)-5-methoxypyrimidin-4-yl]sulfanyl}acetate
| Molecular Formula | C11H17N3O3S |
|---|---|
| Molecular Weight | 271.10 g/mol |
| LogP | 1.2064 |
| Topological Polar Surface Area | 64.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 271.09906 |
| Heavy Atoms | 18 |
| Complexity | 412.51996 |
Chemical Identifiers
| CAS Number | 400084-01-7 |
|---|---|
| SMILES | CCOC(=O)CSC1=NC(=NC=C1OC)N(C)C |
Product Overview
Ethyl 2-{[2-(dimethylamino)-5-methoxy-4-pyrimidinyl]sulfanyl}acetate (CAS 400084-01-7), with molecular formula C11H17N3O3S and molecular weight 271.10 g/mol. IUPAC: ethyl 2-[2-(dimethylamino)-5-methoxypyrimidin-4-yl]sulfanylacetate.
Chemical Property Profile of Ethyl 2-{[2-(dimethylamino)-5-methoxy-4-pyrimidinyl]sulfanyl}acetate
Property Insights of Ethyl 2-{[2-(dimethylamino)-5-methoxy-4-pyrimidinyl]sulfanyl}acetate
The XLogP value of 1.2064 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-{[2-(dimethylamino)-5-methoxy-4-pyrimidinyl]sulfanyl}acetate. The TPSA of 64.55 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-{[2-(dimethylamino)-5-methoxy-4-pyrimidinyl]sulfanyl}acetate. Following Lipinski's Rule of Five, Ethyl 2-{[2-(dimethylamino)-5-methoxy-4-pyrimidinyl]sulfanyl}acetate has 0 hydrogen bond donor(s) and 7 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-{[2-(dimethylamino)-5-methoxy-4-pyrimidinyl]sulfanyl}acetate?
The CAS number of Ethyl 2-{[2-(dimethylamino)-5-methoxy-4-pyrimidinyl]sulfanyl}acetate is 400084-01-7.
What is the molecular formula of Ethyl 2-{[2-(dimethylamino)-5-methoxy-4-pyrimidinyl]sulfanyl}acetate?
The molecular formula of Ethyl 2-{[2-(dimethylamino)-5-methoxy-4-pyrimidinyl]sulfanyl}acetate is C11H17N3O3S.
What is the molecular weight of Ethyl 2-{[2-(dimethylamino)-5-methoxy-4-pyrimidinyl]sulfanyl}acetate?
The molecular weight of Ethyl 2-{[2-(dimethylamino)-5-methoxy-4-pyrimidinyl]sulfanyl}acetate is 271.10 g/mol.
Where can I buy Ethyl 2-{[2-(dimethylamino)-5-methoxy-4-pyrimidinyl]sulfanyl}acetate?
You can request a quote for Ethyl 2-{[2-(dimethylamino)-5-methoxy-4-pyrimidinyl]sulfanyl}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-{[2-(dimethylamino)-5-methoxy-4-pyrimidinyl]sulfanyl}acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-{[2-(dimethylamino)-5-methoxy-4-pyrimidinyl]sulfanyl}acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.