![7-chloro-2-(methylsulfanyl)-3-(propan-2-yl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione structure](/static/products/904/904264-68-2.png)
7-chloro-2-(methylsulfanyl)-3-(propan-2-yl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
TL;DR: 7-chloro-2-(methylsulfanyl)-3-(propan-2-yl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione (CAS 904264-68-2) is a chemical compound with molecular formula C15H13ClN2O3S and molecular weight 336.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-chloro-2-methylsulfanyl-3-propan-2-ylchromeno[2,3-d]pyrimidine-4,5-dione
Also Known As: 7-chloro-2-(methylsulfanyl)-3-(propan-2-yl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione, 7-chloro-2-methylsulfanyl-3-propan-2-ylchromeno[2,3-d]pyrimidine-4,5-dione, 7-chloro-3-isopropyl-2-(methylthio)-3H-chromeno[2,3-d]pyrimidine-4,5-dione
| Molecular Formula | C15H13ClN2O3S |
|---|---|
| Molecular Weight | 336.03 g/mol |
| LogP | 3.4591 |
| Topological Polar Surface Area | 65.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 336.03354 |
| Heavy Atoms | 22 |
| Complexity | 1007.4871 |
Chemical Identifiers
| CAS Number | 904264-68-2 |
|---|---|
| SMILES | CC(C)N1C(=O)C2=C(N=C1SC)OC3=C(C2=O)C=C(C=C3)Cl |
Product Overview
7-chloro-2-(methylsulfanyl)-3-(propan-2-yl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione (CAS 904264-68-2), with molecular formula C15H13ClN2O3S and molecular weight 336.03 g/mol. IUPAC: 7-chloro-2-methylsulfanyl-3-propan-2-ylchromeno[2,3-d]pyrimidine-4,5-dione.
Chemical Property Profile of 7-chloro-2-(methylsulfanyl)-3-(propan-2-yl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Property Insights of 7-chloro-2-(methylsulfanyl)-3-(propan-2-yl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
The XLogP value of 3.4591 indicates that 7-chloro-2-(methylsulfanyl)-3-(propan-2-yl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-chloro-2-(methylsulfanyl)-3-(propan-2-yl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione. Following Lipinski's Rule of Five, 7-chloro-2-(methylsulfanyl)-3-(propan-2-yl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione 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 7-chloro-2-(methylsulfanyl)-3-(propan-2-yl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione?
The CAS number of 7-chloro-2-(methylsulfanyl)-3-(propan-2-yl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione is 904264-68-2.
What is the molecular formula of 7-chloro-2-(methylsulfanyl)-3-(propan-2-yl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione?
The molecular formula of 7-chloro-2-(methylsulfanyl)-3-(propan-2-yl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione is C15H13ClN2O3S.
What is the molecular weight of 7-chloro-2-(methylsulfanyl)-3-(propan-2-yl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione?
The molecular weight of 7-chloro-2-(methylsulfanyl)-3-(propan-2-yl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione is 336.03 g/mol.
Where can I buy 7-chloro-2-(methylsulfanyl)-3-(propan-2-yl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione?
You can request a quote for 7-chloro-2-(methylsulfanyl)-3-(propan-2-yl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-chloro-2-(methylsulfanyl)-3-(propan-2-yl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-chloro-2-(methylsulfanyl)-3-(propan-2-yl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.