2-Aminopyrimidine-4(1H)-thione
TL;DR: 2-Aminopyrimidine-4(1H)-thione (CAS 1193-27-7) is a chemical compound with molecular formula C4H5N3S and molecular weight 127.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-1H-pyrimidine-6-thione
Also Known As: 2-amino-1H-pyrimidine-6-thione, amino-6-mercaptopyrimidine, 2-Aminopyrimidine-4-thiol, 2-Amino-4-mercaptopyrimidine, 2-Aminopyrimidine-4(1H)-thione
| Molecular Formula | C4H5N3S |
|---|---|
| Molecular Weight | 127.02 g/mol |
| LogP | 0.72139 |
| Topological Polar Surface Area | 54.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 127.02042 |
| Heavy Atoms | 8 |
| Complexity | 228.72507 |
Chemical Identifiers
| CAS Number | 1193-27-7 |
|---|---|
| SMILES | C1=CN=C(NC1=S)N |
Product Overview
2-Aminopyrimidine-4(1H)-thione (CAS 1193-27-7), with molecular formula C4H5N3S and molecular weight 127.02 g/mol. IUPAC: 2-amino-1H-pyrimidine-6-thione.
Chemical Property Profile of 2-Aminopyrimidine-4(1H)-thione
Property Insights of 2-Aminopyrimidine-4(1H)-thione
The XLogP value of 0.72139 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Aminopyrimidine-4(1H)-thione. With a topological polar surface area (TPSA) of 54.7 Ų, 2-Aminopyrimidine-4(1H)-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Aminopyrimidine-4(1H)-thione has 2 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-Aminopyrimidine-4(1H)-thione?
The CAS number of 2-Aminopyrimidine-4(1H)-thione is 1193-27-7.
What is the molecular formula of 2-Aminopyrimidine-4(1H)-thione?
The molecular formula of 2-Aminopyrimidine-4(1H)-thione is C4H5N3S.
What is the molecular weight of 2-Aminopyrimidine-4(1H)-thione?
The molecular weight of 2-Aminopyrimidine-4(1H)-thione is 127.02 g/mol.
Where can I buy 2-Aminopyrimidine-4(1H)-thione?
You can request a quote for 2-Aminopyrimidine-4(1H)-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Aminopyrimidine-4(1H)-thione?
Yes, KEHONG BIO provides custom synthesis services for 2-Aminopyrimidine-4(1H)-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.