![Methyl 5-(3,4-dimethoxyphenyl)-4-oxothieno[2,3-d]pyrimidine-3(4H)-acetate structure](/static/products/4391/439140-54-2.webp)
Methyl 5-(3,4-dimethoxyphenyl)-4-oxothieno[2,3-d]pyrimidine-3(4H)-acetate
TL;DR: Methyl 5-(3,4-dimethoxyphenyl)-4-oxothieno[2,3-d]pyrimidine-3(4H)-acetate (CAS 439140-54-2) is a chemical compound with molecular formula C17H16N2O5S and molecular weight 360.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[5-(3,4-dimethoxyphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]acetate
Also Known As: ChemDiv2_000929, Methyl 5-(3,4-dimethoxyphenyl)-4-oxothieno[2,3-d]pyrimidine-3(4H)-acetate, methyl [5-(3,4-dimethoxyphenyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetate, methyl 2-[5-(3,4-dimethoxyphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]acetate
| Molecular Formula | C17H16N2O5S |
|---|---|
| Molecular Weight | 360.08 g/mol |
| LogP | 2.3152 |
| Topological Polar Surface Area | 79.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 360.078 |
| Heavy Atoms | 25 |
| Complexity | 992.3572 |
Chemical Identifiers
| CAS Number | 439140-54-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC(=O)OC)OC |
Product Overview
Methyl 5-(3,4-dimethoxyphenyl)-4-oxothieno[2,3-d]pyrimidine-3(4H)-acetate (CAS 439140-54-2), with molecular formula C17H16N2O5S and molecular weight 360.08 g/mol. IUPAC: methyl 2-[5-(3,4-dimethoxyphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]acetate.
Chemical Property Profile of Methyl 5-(3,4-dimethoxyphenyl)-4-oxothieno[2,3-d]pyrimidine-3(4H)-acetate
Property Insights of Methyl 5-(3,4-dimethoxyphenyl)-4-oxothieno[2,3-d]pyrimidine-3(4H)-acetate
The XLogP value of 2.3152 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 5-(3,4-dimethoxyphenyl)-4-oxothieno[2,3-d]pyrimidine-3(4H)-acetate. The TPSA of 79.65 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 5-(3,4-dimethoxyphenyl)-4-oxothieno[2,3-d]pyrimidine-3(4H)-acetate. Following Lipinski's Rule of Five, Methyl 5-(3,4-dimethoxyphenyl)-4-oxothieno[2,3-d]pyrimidine-3(4H)-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 Methyl 5-(3,4-dimethoxyphenyl)-4-oxothieno[2,3-d]pyrimidine-3(4H)-acetate?
The CAS number of Methyl 5-(3,4-dimethoxyphenyl)-4-oxothieno[2,3-d]pyrimidine-3(4H)-acetate is 439140-54-2.
What is the molecular formula of Methyl 5-(3,4-dimethoxyphenyl)-4-oxothieno[2,3-d]pyrimidine-3(4H)-acetate?
The molecular formula of Methyl 5-(3,4-dimethoxyphenyl)-4-oxothieno[2,3-d]pyrimidine-3(4H)-acetate is C17H16N2O5S.
What is the molecular weight of Methyl 5-(3,4-dimethoxyphenyl)-4-oxothieno[2,3-d]pyrimidine-3(4H)-acetate?
The molecular weight of Methyl 5-(3,4-dimethoxyphenyl)-4-oxothieno[2,3-d]pyrimidine-3(4H)-acetate is 360.08 g/mol.
Where can I buy Methyl 5-(3,4-dimethoxyphenyl)-4-oxothieno[2,3-d]pyrimidine-3(4H)-acetate?
You can request a quote for Methyl 5-(3,4-dimethoxyphenyl)-4-oxothieno[2,3-d]pyrimidine-3(4H)-acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 5-(3,4-dimethoxyphenyl)-4-oxothieno[2,3-d]pyrimidine-3(4H)-acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 5-(3,4-dimethoxyphenyl)-4-oxothieno[2,3-d]pyrimidine-3(4H)-acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.