4-Amino-6-hydroxy-2-mercaptopyrimidine monohydrate
TL;DR: 4-Amino-6-hydroxy-2-mercaptopyrimidine monohydrate (CAS 1004-40-6) is a chemical compound with molecular formula C4H7N3O2S and molecular weight 161.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-2-sulfanylidene-1H-pyrimidin-4-one;hydrate
Also Known As: 4-Amino-6-hydroxy-2-mercaptopyrimidine monohydrate, 6-Amino-2-thiouracil monohydrate, 6-Amino-2-thiouracil, zlchem 473, zlchem 871
| Molecular Formula | C4H7N3O2S |
|---|---|
| Molecular Weight | 161.03 g/mol |
| LogP | -0.81001 |
| Topological Polar Surface Area | 106.17 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 161.0259 |
| Heavy Atoms | 10 |
| Complexity | 286.519 |
Chemical Identifiers
| CAS Number | 1004-40-6 |
|---|---|
| SMILES | C1=C(NC(=S)NC1=O)N.O |
Product Overview
4-Amino-6-hydroxy-2-mercaptopyrimidine monohydrate (CAS 1004-40-6), with molecular formula C4H7N3O2S and molecular weight 161.03 g/mol. IUPAC: 6-amino-2-sulfanylidene-1H-pyrimidin-4-one;hydrate.
Chemical Property Profile of 4-Amino-6-hydroxy-2-mercaptopyrimidine monohydrate
Property Insights of 4-Amino-6-hydroxy-2-mercaptopyrimidine monohydrate
The XLogP value of -0.81001 indicates that 4-Amino-6-hydroxy-2-mercaptopyrimidine monohydrate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 106.17 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-6-hydroxy-2-mercaptopyrimidine monohydrate. Following Lipinski's Rule of Five, 4-Amino-6-hydroxy-2-mercaptopyrimidine monohydrate 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 4-Amino-6-hydroxy-2-mercaptopyrimidine monohydrate?
The CAS number of 4-Amino-6-hydroxy-2-mercaptopyrimidine monohydrate is 1004-40-6.
What is the molecular formula of 4-Amino-6-hydroxy-2-mercaptopyrimidine monohydrate?
The molecular formula of 4-Amino-6-hydroxy-2-mercaptopyrimidine monohydrate is C4H7N3O2S.
What is the molecular weight of 4-Amino-6-hydroxy-2-mercaptopyrimidine monohydrate?
The molecular weight of 4-Amino-6-hydroxy-2-mercaptopyrimidine monohydrate is 161.03 g/mol.
Where can I buy 4-Amino-6-hydroxy-2-mercaptopyrimidine monohydrate?
You can request a quote for 4-Amino-6-hydroxy-2-mercaptopyrimidine monohydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Amino-6-hydroxy-2-mercaptopyrimidine monohydrate?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-6-hydroxy-2-mercaptopyrimidine monohydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.