![2-sulfanylidene-5,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-4,6-dione structure](/static/products/973/97337-30-9.png)
2-sulfanylidene-5,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-4,6-dione
TL;DR: 2-sulfanylidene-5,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-4,6-dione (CAS 97337-30-9) is a chemical compound with molecular formula C6H5N3O2S and molecular weight 183.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-sulfanylidene-5,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-4,6-dione
Also Known As: 2-MERCAPTO-7H-PYRROLO[2,3-D]PYRIMIDINE-4,6-DIOL, 2-sulfanylidene-5,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-4,6-dione
| Molecular Formula | C6H5N3O2S |
|---|---|
| Molecular Weight | 183.01 g/mol |
| LogP | -0.07291 |
| Topological Polar Surface Area | 77.75 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 183.01025 |
| Heavy Atoms | 12 |
| Complexity | 458.59637 |
Chemical Identifiers
| CAS Number | 97337-30-9 |
|---|---|
| SMILES | C1C2=C(NC1=O)NC(=S)NC2=O |
Product Overview
2-sulfanylidene-5,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-4,6-dione (CAS 97337-30-9), with molecular formula C6H5N3O2S and molecular weight 183.01 g/mol. IUPAC: 2-sulfanylidene-5,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-4,6-dione.
Chemical Property Profile of 2-sulfanylidene-5,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-4,6-dione
Property Insights of 2-sulfanylidene-5,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-4,6-dione
The XLogP value of -0.07291 indicates that 2-sulfanylidene-5,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-4,6-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 77.75 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-sulfanylidene-5,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-4,6-dione. Following Lipinski's Rule of Five, 2-sulfanylidene-5,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-4,6-dione has 3 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-sulfanylidene-5,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-4,6-dione?
The CAS number of 2-sulfanylidene-5,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-4,6-dione is 97337-30-9.
What is the molecular formula of 2-sulfanylidene-5,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-4,6-dione?
The molecular formula of 2-sulfanylidene-5,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-4,6-dione is C6H5N3O2S.
What is the molecular weight of 2-sulfanylidene-5,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-4,6-dione?
The molecular weight of 2-sulfanylidene-5,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-4,6-dione is 183.01 g/mol.
Where can I buy 2-sulfanylidene-5,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-4,6-dione?
You can request a quote for 2-sulfanylidene-5,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-4,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-sulfanylidene-5,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-4,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-sulfanylidene-5,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.