![5-Phenylthieno[2,3-d]pyrimidine-4-thiol structure](/static/products/3125/31253-34-6.webp)
5-Phenylthieno[2,3-d]pyrimidine-4-thiol
TL;DR: 5-Phenylthieno[2,3-d]pyrimidine-4-thiol (CAS 31253-34-6) is a chemical compound with molecular formula C12H8N2S2 and molecular weight 244.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-phenyl-3H-thieno[2,3-d]pyrimidine-4-thione
Also Known As: 5-phenylthieno[2,3-d]pyrimidine-4-thiol, 5-Phenyl-thieno[2,3-d]pyrimidine-4-thiol, IFLab1_003325, 5-phenyl-3H-thieno[2,3-d]pyrimidine-4-thione, SDCCGSBI-0659385.P001
| Molecular Formula | C12H8N2S2 |
|---|---|
| Molecular Weight | 244.01 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 84.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 244.0129 |
| Heavy Atoms | 16 |
| Complexity | 310.0 |
Chemical Identifiers
| CAS Number | 31253-34-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CSC3=C2C(=S)NC=N3 |
| InChIKey | LNOFOMVIGAWPSJ-UHFFFAOYSA-N |
Product Overview
5-Phenylthieno[2,3-d]pyrimidine-4-thiol (CAS 31253-34-6), with molecular formula C12H8N2S2 and molecular weight 244.01 g/mol. IUPAC: 5-phenyl-3H-thieno[2,3-d]pyrimidine-4-thione.
Chemical Property Profile of 5-Phenylthieno[2,3-d]pyrimidine-4-thiol
Property Insights of 5-Phenylthieno[2,3-d]pyrimidine-4-thiol
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Phenylthieno[2,3-d]pyrimidine-4-thiol. The TPSA of 84.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Phenylthieno[2,3-d]pyrimidine-4-thiol. Following Lipinski's Rule of Five, 5-Phenylthieno[2,3-d]pyrimidine-4-thiol 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 5-Phenylthieno[2,3-d]pyrimidine-4-thiol?
The CAS number of 5-Phenylthieno[2,3-d]pyrimidine-4-thiol is 31253-34-6.
What is the molecular formula of 5-Phenylthieno[2,3-d]pyrimidine-4-thiol?
The molecular formula of 5-Phenylthieno[2,3-d]pyrimidine-4-thiol is C12H8N2S2.
What is the molecular weight of 5-Phenylthieno[2,3-d]pyrimidine-4-thiol?
The molecular weight of 5-Phenylthieno[2,3-d]pyrimidine-4-thiol is 244.01 g/mol.
Where can I buy 5-Phenylthieno[2,3-d]pyrimidine-4-thiol?
You can request a quote for 5-Phenylthieno[2,3-d]pyrimidine-4-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Phenylthieno[2,3-d]pyrimidine-4-thiol?
Yes, KEHONG BIO provides custom synthesis services for 5-Phenylthieno[2,3-d]pyrimidine-4-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.