![7,9-dibromo-2-(hexylthio)-3H-chromeno[2,3-d]pyrimidine-4,5-dione structure](/static/products/713/713093-41-5.png)
7,9-dibromo-2-(hexylthio)-3H-chromeno[2,3-d]pyrimidine-4,5-dione
TL;DR: 7,9-dibromo-2-(hexylthio)-3H-chromeno[2,3-d]pyrimidine-4,5-dione (CAS 713093-41-5) is a chemical compound with molecular formula C17H16Br2N2O3S and molecular weight 485.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7,9-dibromo-2-hexylsulfanyl-3H-chromeno[2,3-d]pyrimidine-4,5-dione
Also Known As: 7,9-dibromo-2-(hexylthio)-3H-chromeno[2,3-d]pyrimidine-4,5-dione, 7,9-dibromo-2-(hexylsulfanyl)-4-hydroxy-5H-chromeno[2,3-d]pyrimidin-5-one, 7,9-dibromo-2-hexylsulfanyl-3H-chromeno[2,3-d]pyrimidine-4,5-dione
| Molecular Formula | C17H16Br2N2O3S |
|---|---|
| Molecular Weight | 485.92 g/mol |
| LogP | 5.2269 |
| Topological Polar Surface Area | 75.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 485.92484 |
| Heavy Atoms | 25 |
| Complexity | 1045.898 |
Chemical Identifiers
| CAS Number | 713093-41-5 |
|---|---|
| SMILES | CCCCCCSC1=NC2=C(C(=O)C3=C(O2)C(=CC(=C3)Br)Br)C(=O)N1 |
Product Overview
7,9-dibromo-2-(hexylthio)-3H-chromeno[2,3-d]pyrimidine-4,5-dione (CAS 713093-41-5), with molecular formula C17H16Br2N2O3S and molecular weight 485.92 g/mol. IUPAC: 7,9-dibromo-2-hexylsulfanyl-3H-chromeno[2,3-d]pyrimidine-4,5-dione.
Chemical Property Profile of 7,9-dibromo-2-(hexylthio)-3H-chromeno[2,3-d]pyrimidine-4,5-dione
Property Insights of 7,9-dibromo-2-(hexylthio)-3H-chromeno[2,3-d]pyrimidine-4,5-dione
The XLogP value of 5.2269 indicates that 7,9-dibromo-2-(hexylthio)-3H-chromeno[2,3-d]pyrimidine-4,5-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.96 Ų falls within the moderate polarity range, balancing permeability and solubility for 7,9-dibromo-2-(hexylthio)-3H-chromeno[2,3-d]pyrimidine-4,5-dione. Following Lipinski's Rule of Five, 7,9-dibromo-2-(hexylthio)-3H-chromeno[2,3-d]pyrimidine-4,5-dione has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7,9-dibromo-2-(hexylthio)-3H-chromeno[2,3-d]pyrimidine-4,5-dione?
The CAS number of 7,9-dibromo-2-(hexylthio)-3H-chromeno[2,3-d]pyrimidine-4,5-dione is 713093-41-5.
What is the molecular formula of 7,9-dibromo-2-(hexylthio)-3H-chromeno[2,3-d]pyrimidine-4,5-dione?
The molecular formula of 7,9-dibromo-2-(hexylthio)-3H-chromeno[2,3-d]pyrimidine-4,5-dione is C17H16Br2N2O3S.
What is the molecular weight of 7,9-dibromo-2-(hexylthio)-3H-chromeno[2,3-d]pyrimidine-4,5-dione?
The molecular weight of 7,9-dibromo-2-(hexylthio)-3H-chromeno[2,3-d]pyrimidine-4,5-dione is 485.92 g/mol.
Where can I buy 7,9-dibromo-2-(hexylthio)-3H-chromeno[2,3-d]pyrimidine-4,5-dione?
You can request a quote for 7,9-dibromo-2-(hexylthio)-3H-chromeno[2,3-d]pyrimidine-4,5-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7,9-dibromo-2-(hexylthio)-3H-chromeno[2,3-d]pyrimidine-4,5-dione?
Yes, KEHONG BIO provides custom synthesis services for 7,9-dibromo-2-(hexylthio)-3H-chromeno[2,3-d]pyrimidine-4,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.