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2-methylthieno[2,3-d]pyrimidine-4(3H)-thione
TL;DR: 2-methylthieno[2,3-d]pyrimidine-4(3H)-thione (CAS 56844-34-9) is a chemical compound with molecular formula C7H6N2S2 and molecular weight 182.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-3H-thieno[2,3-d]pyrimidine-4-thione
Also Known As: 2-methyl-3H-thieno[2,3-d]pyrimidine-4-thione, 2-methylthieno[2,3-d]pyrimidine-4(3H)-thione, 2-methyl-3H,4H-thieno[2,3-d]pyrimidine-4-thione, Thieno[2,3-d]pyrimidine-4(3H)-thione, 2-methyl-, Dihydro-3,4 methyl-2 thioxo-4 thieno[2,3-d]pyrimidin
| Molecular Formula | C7H6N2S2 |
|---|---|
| Molecular Weight | 182.00 g/mol |
| LogP | 2.66231 |
| Topological Polar Surface Area | 28.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 181.99724 |
| Heavy Atoms | 11 |
| Complexity | 440.88245 |
Chemical Identifiers
| CAS Number | 56844-34-9 |
|---|---|
| SMILES | CC1=NC2=C(C=CS2)C(=S)N1 |
Product Overview
2-methylthieno[2,3-d]pyrimidine-4(3H)-thione (CAS 56844-34-9), with molecular formula C7H6N2S2 and molecular weight 182.00 g/mol. IUPAC: 2-methyl-3H-thieno[2,3-d]pyrimidine-4-thione.
Chemical Property Profile of 2-methylthieno[2,3-d]pyrimidine-4(3H)-thione
Property Insights of 2-methylthieno[2,3-d]pyrimidine-4(3H)-thione
The XLogP value of 2.66231 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-methylthieno[2,3-d]pyrimidine-4(3H)-thione. With a topological polar surface area (TPSA) of 28.68 Ų, 2-methylthieno[2,3-d]pyrimidine-4(3H)-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-methylthieno[2,3-d]pyrimidine-4(3H)-thione has 1 hydrogen bond donor(s) and 3 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-methylthieno[2,3-d]pyrimidine-4(3H)-thione?
The CAS number of 2-methylthieno[2,3-d]pyrimidine-4(3H)-thione is 56844-34-9.
What is the molecular formula of 2-methylthieno[2,3-d]pyrimidine-4(3H)-thione?
The molecular formula of 2-methylthieno[2,3-d]pyrimidine-4(3H)-thione is C7H6N2S2.
What is the molecular weight of 2-methylthieno[2,3-d]pyrimidine-4(3H)-thione?
The molecular weight of 2-methylthieno[2,3-d]pyrimidine-4(3H)-thione is 182.00 g/mol.
Where can I buy 2-methylthieno[2,3-d]pyrimidine-4(3H)-thione?
You can request a quote for 2-methylthieno[2,3-d]pyrimidine-4(3H)-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methylthieno[2,3-d]pyrimidine-4(3H)-thione?
Yes, KEHONG BIO provides custom synthesis services for 2-methylthieno[2,3-d]pyrimidine-4(3H)-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.