![Dimethyl 5-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxy]isophthalate structure](/static/products/3156/315677-41-9.webp)
Dimethyl 5-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxy]isophthalate
TL;DR: Dimethyl 5-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxy]isophthalate (CAS 315677-41-9) is a chemical compound with molecular formula C22H16N2O5S and molecular weight 420.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 5-(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxybenzene-1,3-dicarboxylate
Also Known As: ChemDiv1_008177, DivK1c_002817, CDS1_001777, dimethyl 5-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxy]isophthalate, AF-399/15539273
| Molecular Formula | C22H16N2O5S |
|---|---|
| Molecular Weight | 420.08 g/mol |
| LogP | 4.7238 |
| Topological Polar Surface Area | 87.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 420.078 |
| Heavy Atoms | 30 |
| Complexity | 1202.7555 |
Chemical Identifiers
| CAS Number | 315677-41-9 |
|---|---|
| SMILES | COC(=O)C1=CC(=CC(=C1)OC2=C3C(=CSC3=NC=N2)C4=CC=CC=C4)C(=O)OC |
Product Overview
Dimethyl 5-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxy]isophthalate (CAS 315677-41-9), with molecular formula C22H16N2O5S and molecular weight 420.08 g/mol. IUPAC: dimethyl 5-(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxybenzene-1,3-dicarboxylate.
Chemical Property Profile of Dimethyl 5-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxy]isophthalate
Property Insights of Dimethyl 5-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxy]isophthalate
The XLogP value of 4.7238 indicates that Dimethyl 5-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxy]isophthalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.61 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 5-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxy]isophthalate. Following Lipinski's Rule of Five, Dimethyl 5-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxy]isophthalate has 0 hydrogen bond donor(s) and 8 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 Dimethyl 5-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxy]isophthalate?
The CAS number of Dimethyl 5-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxy]isophthalate is 315677-41-9.
What is the molecular formula of Dimethyl 5-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxy]isophthalate?
The molecular formula of Dimethyl 5-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxy]isophthalate is C22H16N2O5S.
What is the molecular weight of Dimethyl 5-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxy]isophthalate?
The molecular weight of Dimethyl 5-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxy]isophthalate is 420.08 g/mol.
Where can I buy Dimethyl 5-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxy]isophthalate?
You can request a quote for Dimethyl 5-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxy]isophthalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 5-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxy]isophthalate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 5-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxy]isophthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.