AF-399/15392086
TL;DR: AF-399/15392086 (CAS 314261-78-4) is a chemical compound with molecular formula C20H20N2O5S and molecular weight 400.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 5-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)oxybenzene-1,3-dicarboxylate
Also Known As: AF-399/15392086, diethyl 5-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)oxy]benzene-1,3-dicarboxylate, diethyl 5-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)oxy]isophthalate, diethyl 5-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)oxybenzene-1,3-dicarboxylate, ethyl 5-(5,6-dimethylthiopheno[3,2-e]pyrimidin-4-yloxy)-3-(ethoxycarbonyl)benz oate
| Molecular Formula | C20H20N2O5S |
|---|---|
| Molecular Weight | 400.11 g/mol |
| LogP | 4.45384 |
| Topological Polar Surface Area | 87.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 400.10928 |
| Heavy Atoms | 28 |
| Complexity | 1008.24725 |
Chemical Identifiers
| CAS Number | 314261-78-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=CC(=C1)OC2=C3C(=C(SC3=NC=N2)C)C)C(=O)OCC |
Product Overview
AF-399/15392086 (CAS 314261-78-4), with molecular formula C20H20N2O5S and molecular weight 400.11 g/mol. IUPAC: diethyl 5-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)oxybenzene-1,3-dicarboxylate.
Chemical Property Profile of AF-399/15392086
Property Insights of AF-399/15392086
The XLogP value of 4.45384 indicates that AF-399/15392086 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 AF-399/15392086. Following Lipinski's Rule of Five, AF-399/15392086 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 AF-399/15392086?
The CAS number of AF-399/15392086 is 314261-78-4.
What is the molecular formula of AF-399/15392086?
The molecular formula of AF-399/15392086 is C20H20N2O5S.
What is the molecular weight of AF-399/15392086?
The molecular weight of AF-399/15392086 is 400.11 g/mol.
Where can I buy AF-399/15392086?
You can request a quote for AF-399/15392086 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/15392086?
Yes, KEHONG BIO provides custom synthesis services for AF-399/15392086 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.