![ethyl 9-methyl-5H-thiochromeno[4,3-d]pyrimidin-2-yl sulfide structure](/static/products/4782/478246-88-7.webp)
ethyl 9-methyl-5H-thiochromeno[4,3-d]pyrimidin-2-yl sulfide
TL;DR: ethyl 9-methyl-5H-thiochromeno[4,3-d]pyrimidin-2-yl sulfide (CAS 478246-88-7) is a chemical compound with molecular formula C14H14N2S2 and molecular weight 274.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylsulfanyl-9-methyl-5H-thiochromeno[4,3-d]pyrimidine
Also Known As: ethyl 9-methyl-5H-thiochromeno[4,3-d]pyrimidin-2-yl sulfide, 9N-326S, 2-ethylsulfanyl-9-methyl-5H-thiochromeno[4,3-d]pyrimidine, 2-(ethylsulfanyl)-9-methyl-5H-thiochromeno[4,3-d]pyrimidine, 5H-[1]Benzothiopyrano[4,3-d]pyrimidine, 2-(ethylthio)-9-methyl-
| Molecular Formula | C14H14N2S2 |
|---|---|
| Molecular Weight | 274.06 g/mol |
| LogP | 4.16972 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 274.05984 |
| Heavy Atoms | 18 |
| Complexity | 596.343 |
Chemical Identifiers
| CAS Number | 478246-88-7 |
|---|---|
| SMILES | CCSC1=NC=C2CSC3=C(C2=N1)C=C(C=C3)C |
Product Overview
ethyl 9-methyl-5H-thiochromeno[4,3-d]pyrimidin-2-yl sulfide (CAS 478246-88-7), with molecular formula C14H14N2S2 and molecular weight 274.06 g/mol. IUPAC: 2-ethylsulfanyl-9-methyl-5H-thiochromeno[4,3-d]pyrimidine.
Chemical Property Profile of ethyl 9-methyl-5H-thiochromeno[4,3-d]pyrimidin-2-yl sulfide
Property Insights of ethyl 9-methyl-5H-thiochromeno[4,3-d]pyrimidin-2-yl sulfide
The XLogP value of 4.16972 indicates that ethyl 9-methyl-5H-thiochromeno[4,3-d]pyrimidin-2-yl sulfide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.78 Ų, ethyl 9-methyl-5H-thiochromeno[4,3-d]pyrimidin-2-yl sulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl 9-methyl-5H-thiochromeno[4,3-d]pyrimidin-2-yl sulfide has 0 hydrogen bond donor(s) and 4 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 ethyl 9-methyl-5H-thiochromeno[4,3-d]pyrimidin-2-yl sulfide?
The CAS number of ethyl 9-methyl-5H-thiochromeno[4,3-d]pyrimidin-2-yl sulfide is 478246-88-7.
What is the molecular formula of ethyl 9-methyl-5H-thiochromeno[4,3-d]pyrimidin-2-yl sulfide?
The molecular formula of ethyl 9-methyl-5H-thiochromeno[4,3-d]pyrimidin-2-yl sulfide is C14H14N2S2.
What is the molecular weight of ethyl 9-methyl-5H-thiochromeno[4,3-d]pyrimidin-2-yl sulfide?
The molecular weight of ethyl 9-methyl-5H-thiochromeno[4,3-d]pyrimidin-2-yl sulfide is 274.06 g/mol.
Where can I buy ethyl 9-methyl-5H-thiochromeno[4,3-d]pyrimidin-2-yl sulfide?
You can request a quote for ethyl 9-methyl-5H-thiochromeno[4,3-d]pyrimidin-2-yl sulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 9-methyl-5H-thiochromeno[4,3-d]pyrimidin-2-yl sulfide?
Yes, KEHONG BIO provides custom synthesis services for ethyl 9-methyl-5H-thiochromeno[4,3-d]pyrimidin-2-yl sulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.