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methyl (4-oxo-6-phenylthieno[2,3-d]pyrimidin-3(4H)-yl)acetate
TL;DR: methyl (4-oxo-6-phenylthieno[2,3-d]pyrimidin-3(4H)-yl)acetate (CAS 433251-48-0) is a chemical compound with molecular formula C15H12N2O3S and molecular weight 300.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(4-oxo-6-phenylthieno[2,3-d]pyrimidin-3-yl)acetate
Also Known As: TimTec1_007776, BAS 03542955, IDI1_033430, methyl 2-(4-oxo-6-phenylthieno[2,3-d]pyrimidin-3(4H)-yl)acetate, methyl 2-(4-oxo-6-phenylthieno[2,3-d]pyrimidin-3-yl)acetate
| Molecular Formula | C15H12N2O3S |
|---|---|
| Molecular Weight | 300.06 g/mol |
| LogP | 2.298 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 300.05685 |
| Heavy Atoms | 21 |
| Complexity | 852.23126 |
Chemical Identifiers
| CAS Number | 433251-48-0 |
|---|---|
| SMILES | COC(=O)CN1C=NC2=C(C1=O)C=C(S2)C3=CC=CC=C3 |
Product Overview
methyl (4-oxo-6-phenylthieno[2,3-d]pyrimidin-3(4H)-yl)acetate (CAS 433251-48-0), with molecular formula C15H12N2O3S and molecular weight 300.06 g/mol. IUPAC: methyl 2-(4-oxo-6-phenylthieno[2,3-d]pyrimidin-3-yl)acetate.
Chemical Property Profile of methyl (4-oxo-6-phenylthieno[2,3-d]pyrimidin-3(4H)-yl)acetate
Property Insights of methyl (4-oxo-6-phenylthieno[2,3-d]pyrimidin-3(4H)-yl)acetate
The XLogP value of 2.298 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl (4-oxo-6-phenylthieno[2,3-d]pyrimidin-3(4H)-yl)acetate. The TPSA of 61.19 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl (4-oxo-6-phenylthieno[2,3-d]pyrimidin-3(4H)-yl)acetate. Following Lipinski's Rule of Five, methyl (4-oxo-6-phenylthieno[2,3-d]pyrimidin-3(4H)-yl)acetate has 0 hydrogen bond donor(s) and 5 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 (4-oxo-6-phenylthieno[2,3-d]pyrimidin-3(4H)-yl)acetate?
The CAS number of methyl (4-oxo-6-phenylthieno[2,3-d]pyrimidin-3(4H)-yl)acetate is 433251-48-0.
What is the molecular formula of methyl (4-oxo-6-phenylthieno[2,3-d]pyrimidin-3(4H)-yl)acetate?
The molecular formula of methyl (4-oxo-6-phenylthieno[2,3-d]pyrimidin-3(4H)-yl)acetate is C15H12N2O3S.
What is the molecular weight of methyl (4-oxo-6-phenylthieno[2,3-d]pyrimidin-3(4H)-yl)acetate?
The molecular weight of methyl (4-oxo-6-phenylthieno[2,3-d]pyrimidin-3(4H)-yl)acetate is 300.06 g/mol.
Where can I buy methyl (4-oxo-6-phenylthieno[2,3-d]pyrimidin-3(4H)-yl)acetate?
You can request a quote for methyl (4-oxo-6-phenylthieno[2,3-d]pyrimidin-3(4H)-yl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl (4-oxo-6-phenylthieno[2,3-d]pyrimidin-3(4H)-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for methyl (4-oxo-6-phenylthieno[2,3-d]pyrimidin-3(4H)-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.