6-Formyl-2-thiouracil
TL;DR: 6-Formyl-2-thiouracil (CAS 16953-46-1) is a chemical compound with molecular formula C5H4N2O2S and molecular weight 156.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxo-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde
Also Known As: 6-Formyl-2-thiouracil, 6-Formyl-2-thiouracilhydrate, 4-oxo-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde, 6-Oxo-2-thioxo-1,2,3,6-tetrahydropyrimidine-4-carbaldehyde, 6-Hydroxy-2-sulfanylpyrimidine-4-carbaldehyde
| Molecular Formula | C5H4N2O2S |
|---|---|
| Molecular Weight | 156.00 g/mol |
| LogP | 0.24499 |
| Topological Polar Surface Area | 65.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 155.99934 |
| Heavy Atoms | 10 |
| Complexity | 322.90585 |
Chemical Identifiers
| CAS Number | 16953-46-1 |
|---|---|
| SMILES | C1=C(NC(=S)NC1=O)C=O |
Product Overview
6-Formyl-2-thiouracil (CAS 16953-46-1), with molecular formula C5H4N2O2S and molecular weight 156.00 g/mol. IUPAC: 4-oxo-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde.
Chemical Property Profile of 6-Formyl-2-thiouracil
Property Insights of 6-Formyl-2-thiouracil
The XLogP value of 0.24499 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Formyl-2-thiouracil. The TPSA of 65.72 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Formyl-2-thiouracil. Following Lipinski's Rule of Five, 6-Formyl-2-thiouracil 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 6-Formyl-2-thiouracil?
The CAS number of 6-Formyl-2-thiouracil is 16953-46-1.
What is the molecular formula of 6-Formyl-2-thiouracil?
The molecular formula of 6-Formyl-2-thiouracil is C5H4N2O2S.
What is the molecular weight of 6-Formyl-2-thiouracil?
The molecular weight of 6-Formyl-2-thiouracil is 156.00 g/mol.
Where can I buy 6-Formyl-2-thiouracil?
You can request a quote for 6-Formyl-2-thiouracil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Formyl-2-thiouracil?
Yes, KEHONG BIO provides custom synthesis services for 6-Formyl-2-thiouracil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.