(2-Acetylamino-6-methyl-pyrimidin-4-ylsulfanyl)-acetic acid methyl ester
TL;DR: (2-Acetylamino-6-methyl-pyrimidin-4-ylsulfanyl)-acetic acid methyl ester (CAS 337350-95-5) is a chemical compound with molecular formula C10H13N3O3S and molecular weight 255.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(2-acetamido-6-methylpyrimidin-4-yl)sulfanylacetate
Also Known As: BAS 01258431, methyl 2-((2-acetamido-6-methylpyrimidin-4-yl)thio)acetate, (2-Acetylamino-6-methyl-pyrimidin-4-ylsulfanyl)-acetic acid methyl ester, methyl 2-(2-acetamido-6-methylpyrimidin-4-yl)sulfanylacetate, methyl {[2-(acetylamino)-6-methylpyrimidin-4-yl]sulfanyl}acetate
| Molecular Formula | C10H13N3O3S |
|---|---|
| Molecular Weight | 255.07 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 255.06776 |
| Heavy Atoms | 17 |
| Complexity | 288.0 |
Chemical Identifiers
| CAS Number | 337350-95-5 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)NC(=O)C)SCC(=O)OC |
| InChIKey | ZNBJBTVCAMOYTJ-UHFFFAOYSA-N |
Product Overview
(2-Acetylamino-6-methyl-pyrimidin-4-ylsulfanyl)-acetic acid methyl ester (CAS 337350-95-5), with molecular formula C10H13N3O3S and molecular weight 255.07 g/mol. IUPAC: methyl 2-(2-acetamido-6-methylpyrimidin-4-yl)sulfanylacetate.
Chemical Property Profile of (2-Acetylamino-6-methyl-pyrimidin-4-ylsulfanyl)-acetic acid methyl ester
Property Insights of (2-Acetylamino-6-methyl-pyrimidin-4-ylsulfanyl)-acetic acid methyl ester
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Acetylamino-6-methyl-pyrimidin-4-ylsulfanyl)-acetic acid methyl ester. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-Acetylamino-6-methyl-pyrimidin-4-ylsulfanyl)-acetic acid methyl ester. Following Lipinski's Rule of Five, (2-Acetylamino-6-methyl-pyrimidin-4-ylsulfanyl)-acetic acid methyl ester has 1 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 (2-Acetylamino-6-methyl-pyrimidin-4-ylsulfanyl)-acetic acid methyl ester?
The CAS number of (2-Acetylamino-6-methyl-pyrimidin-4-ylsulfanyl)-acetic acid methyl ester is 337350-95-5.
What is the molecular formula of (2-Acetylamino-6-methyl-pyrimidin-4-ylsulfanyl)-acetic acid methyl ester?
The molecular formula of (2-Acetylamino-6-methyl-pyrimidin-4-ylsulfanyl)-acetic acid methyl ester is C10H13N3O3S.
What is the molecular weight of (2-Acetylamino-6-methyl-pyrimidin-4-ylsulfanyl)-acetic acid methyl ester?
The molecular weight of (2-Acetylamino-6-methyl-pyrimidin-4-ylsulfanyl)-acetic acid methyl ester is 255.07 g/mol.
Where can I buy (2-Acetylamino-6-methyl-pyrimidin-4-ylsulfanyl)-acetic acid methyl ester?
You can request a quote for (2-Acetylamino-6-methyl-pyrimidin-4-ylsulfanyl)-acetic acid methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Acetylamino-6-methyl-pyrimidin-4-ylsulfanyl)-acetic acid methyl ester?
Yes, KEHONG BIO provides custom synthesis services for (2-Acetylamino-6-methyl-pyrimidin-4-ylsulfanyl)-acetic acid methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.