![3-Hydroxythieno[3,4-d]pyrimidine-2,4(1H,3H)-dione structure](/static/products/5322/53229-53-1.webp)
3-Hydroxythieno[3,4-d]pyrimidine-2,4(1H,3H)-dione
TL;DR: 3-Hydroxythieno[3,4-d]pyrimidine-2,4(1H,3H)-dione (CAS 53229-53-1) is a chemical compound with molecular formula C6H4N2O3S and molecular weight 183.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-1H-thieno[3,4-d]pyrimidine-2,4-dione
Also Known As: 3-hydroxy-1H-thieno[3,4-d]pyrimidine-2,4-dione, 3-Hydroxythieno[3,4-d]pyrimidine-2,4(1H,3H)-dione
| Molecular Formula | C6H4N2O3S |
|---|---|
| Molecular Weight | 183.99 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 97.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 183.99426 |
| Heavy Atoms | 12 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 53229-53-1 |
|---|---|
| SMILES | C1=C2C(=CS1)NC(=O)N(C2=O)O |
| InChIKey | LXSWNUOPIMDTEQ-UHFFFAOYSA-N |
Product Overview
3-Hydroxythieno[3,4-d]pyrimidine-2,4(1H,3H)-dione (CAS 53229-53-1), with molecular formula C6H4N2O3S and molecular weight 183.99 g/mol. IUPAC: 3-hydroxy-1H-thieno[3,4-d]pyrimidine-2,4-dione.
Chemical Property Profile of 3-Hydroxythieno[3,4-d]pyrimidine-2,4(1H,3H)-dione
Property Insights of 3-Hydroxythieno[3,4-d]pyrimidine-2,4(1H,3H)-dione
The XLogP value of -0.2 indicates that 3-Hydroxythieno[3,4-d]pyrimidine-2,4(1H,3H)-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 97.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Hydroxythieno[3,4-d]pyrimidine-2,4(1H,3H)-dione. Following Lipinski's Rule of Five, 3-Hydroxythieno[3,4-d]pyrimidine-2,4(1H,3H)-dione has 2 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 3-Hydroxythieno[3,4-d]pyrimidine-2,4(1H,3H)-dione?
The CAS number of 3-Hydroxythieno[3,4-d]pyrimidine-2,4(1H,3H)-dione is 53229-53-1.
What is the molecular formula of 3-Hydroxythieno[3,4-d]pyrimidine-2,4(1H,3H)-dione?
The molecular formula of 3-Hydroxythieno[3,4-d]pyrimidine-2,4(1H,3H)-dione is C6H4N2O3S.
What is the molecular weight of 3-Hydroxythieno[3,4-d]pyrimidine-2,4(1H,3H)-dione?
The molecular weight of 3-Hydroxythieno[3,4-d]pyrimidine-2,4(1H,3H)-dione is 183.99 g/mol.
Where can I buy 3-Hydroxythieno[3,4-d]pyrimidine-2,4(1H,3H)-dione?
You can request a quote for 3-Hydroxythieno[3,4-d]pyrimidine-2,4(1H,3H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hydroxythieno[3,4-d]pyrimidine-2,4(1H,3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxythieno[3,4-d]pyrimidine-2,4(1H,3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.