2-cyclohexyl-3-(furan-2-ylmethyl)-4H-thiochromeno[2,3-d]pyrimidine-4,5(3H)-dione
TL;DR: 2-cyclohexyl-3-(furan-2-ylmethyl)-4H-thiochromeno[2,3-d]pyrimidine-4,5(3H)-dione (CAS 899402-16-5) is a chemical compound with molecular formula C22H20N2O3S and molecular weight 392.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyclohexyl-3-(furan-2-ylmethyl)thiochromeno[2,3-d]pyrimidine-4,5-dione
Also Known As: 2-cyclohexyl-3-(furan-2-ylmethyl)-4H-thiochromeno[2,3-d]pyrimidine-4,5(3H)-dione, 2-cyclohexyl-3-(furan-2-ylmethyl)thiochromeno[2,3-d]pyrimidine-4,5-dione, 2-cyclohexyl-3-(furan-2-ylmethyl)-3H-thiochromeno[2,3-d]pyrimidine-4,5-dione
| Molecular Formula | C22H20N2O3S |
|---|---|
| Molecular Weight | 392.12 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 88.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 392.11948 |
| Heavy Atoms | 28 |
| Complexity | 725.0 |
Chemical Identifiers
| CAS Number | 899402-16-5 |
|---|---|
| SMILES | C1CCC(CC1)C2=NC3=C(C(=O)C4=CC=CC=C4S3)C(=O)N2CC5=CC=CO5 |
| InChIKey | RXWYDJGIPKMRIN-UHFFFAOYSA-N |
Product Overview
2-cyclohexyl-3-(furan-2-ylmethyl)-4H-thiochromeno[2,3-d]pyrimidine-4,5(3H)-dione (CAS 899402-16-5), with molecular formula C22H20N2O3S and molecular weight 392.12 g/mol. IUPAC: 2-cyclohexyl-3-(furan-2-ylmethyl)thiochromeno[2,3-d]pyrimidine-4,5-dione.
Chemical Property Profile of 2-cyclohexyl-3-(furan-2-ylmethyl)-4H-thiochromeno[2,3-d]pyrimidine-4,5(3H)-dione
Property Insights of 2-cyclohexyl-3-(furan-2-ylmethyl)-4H-thiochromeno[2,3-d]pyrimidine-4,5(3H)-dione
The XLogP value of 4.1 indicates that 2-cyclohexyl-3-(furan-2-ylmethyl)-4H-thiochromeno[2,3-d]pyrimidine-4,5(3H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-cyclohexyl-3-(furan-2-ylmethyl)-4H-thiochromeno[2,3-d]pyrimidine-4,5(3H)-dione. Following Lipinski's Rule of Five, 2-cyclohexyl-3-(furan-2-ylmethyl)-4H-thiochromeno[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 2-cyclohexyl-3-(furan-2-ylmethyl)-4H-thiochromeno[2,3-d]pyrimidine-4,5(3H)-dione?
The CAS number of 2-cyclohexyl-3-(furan-2-ylmethyl)-4H-thiochromeno[2,3-d]pyrimidine-4,5(3H)-dione is 899402-16-5.
What is the molecular formula of 2-cyclohexyl-3-(furan-2-ylmethyl)-4H-thiochromeno[2,3-d]pyrimidine-4,5(3H)-dione?
The molecular formula of 2-cyclohexyl-3-(furan-2-ylmethyl)-4H-thiochromeno[2,3-d]pyrimidine-4,5(3H)-dione is C22H20N2O3S.
What is the molecular weight of 2-cyclohexyl-3-(furan-2-ylmethyl)-4H-thiochromeno[2,3-d]pyrimidine-4,5(3H)-dione?
The molecular weight of 2-cyclohexyl-3-(furan-2-ylmethyl)-4H-thiochromeno[2,3-d]pyrimidine-4,5(3H)-dione is 392.12 g/mol.
Where can I buy 2-cyclohexyl-3-(furan-2-ylmethyl)-4H-thiochromeno[2,3-d]pyrimidine-4,5(3H)-dione?
You can request a quote for 2-cyclohexyl-3-(furan-2-ylmethyl)-4H-thiochromeno[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 2-cyclohexyl-3-(furan-2-ylmethyl)-4H-thiochromeno[2,3-d]pyrimidine-4,5(3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-cyclohexyl-3-(furan-2-ylmethyl)-4H-thiochromeno[2,3-d]pyrimidine-4,5(3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.