2,5-diamino-4-sulfanyl-1H-pyrimidine-6-thione
TL;DR: 2,5-diamino-4-sulfanyl-1H-pyrimidine-6-thione (CAS 99171-30-9) is a chemical compound with molecular formula C4H6N4S2 and molecular weight 174.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-diamino-4-sulfanyl-1H-pyrimidine-6-thione
Also Known As: 2,5-diaminopyrimidine-4,6-dithiol, 2,5-diamino-4-sulfanyl-1H-pyrimidine-6-thione, 2,5-diamino-6-sulfanyl-3H-pyrimidine-4-thione
| Molecular Formula | C4H6N4S2 |
|---|---|
| Molecular Weight | 174.00 g/mol |
| LogP | 0.59229 |
| Topological Polar Surface Area | 80.72 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 174.00339 |
| Heavy Atoms | 10 |
| Complexity | 304.61618 |
Chemical Identifiers
| CAS Number | 99171-30-9 |
|---|---|
| SMILES | C1(=C(N=C(NC1=S)N)S)N |
Product Overview
2,5-diamino-4-sulfanyl-1H-pyrimidine-6-thione (CAS 99171-30-9), with molecular formula C4H6N4S2 and molecular weight 174.00 g/mol. IUPAC: 2,5-diamino-4-sulfanyl-1H-pyrimidine-6-thione.
Chemical Property Profile of 2,5-diamino-4-sulfanyl-1H-pyrimidine-6-thione
Property Insights of 2,5-diamino-4-sulfanyl-1H-pyrimidine-6-thione
The XLogP value of 0.59229 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-diamino-4-sulfanyl-1H-pyrimidine-6-thione. The TPSA of 80.72 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,5-diamino-4-sulfanyl-1H-pyrimidine-6-thione. Following Lipinski's Rule of Five, 2,5-diamino-4-sulfanyl-1H-pyrimidine-6-thione has 4 hydrogen bond donor(s) and 5 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 2,5-diamino-4-sulfanyl-1H-pyrimidine-6-thione?
The CAS number of 2,5-diamino-4-sulfanyl-1H-pyrimidine-6-thione is 99171-30-9.
What is the molecular formula of 2,5-diamino-4-sulfanyl-1H-pyrimidine-6-thione?
The molecular formula of 2,5-diamino-4-sulfanyl-1H-pyrimidine-6-thione is C4H6N4S2.
What is the molecular weight of 2,5-diamino-4-sulfanyl-1H-pyrimidine-6-thione?
The molecular weight of 2,5-diamino-4-sulfanyl-1H-pyrimidine-6-thione is 174.00 g/mol.
Where can I buy 2,5-diamino-4-sulfanyl-1H-pyrimidine-6-thione?
You can request a quote for 2,5-diamino-4-sulfanyl-1H-pyrimidine-6-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-diamino-4-sulfanyl-1H-pyrimidine-6-thione?
Yes, KEHONG BIO provides custom synthesis services for 2,5-diamino-4-sulfanyl-1H-pyrimidine-6-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.