甲硫氧嘧啶
TL;DR: 甲硫氧嘧啶 (CAS 56-04-2) is a chemical compound with molecular formula C5H6N2OS and molecular weight 142.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
甲硫氧嘧啶
3-methyl-2-sulfanylidene-1H-pyrimidin-4-one
Also Known As: methylthiouracil, methyl-2-thiouracil, 3-methyl-2-thiouracil, 3-methyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one, 1H,3H-Pyrimidine-4-one-2-thione, 3-methyl-
| Molecular Formula | C5H6N2OS |
|---|---|
| Molecular Weight | 142.02 g/mol |
| LogP | 0.44289 |
| Topological Polar Surface Area | 37.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 142.02008 |
| Heavy Atoms | 9 |
| Complexity | 282.9743 |
Chemical Identifiers
| CAS Number | 56-04-2 |
|---|---|
| SMILES | CN1C(=O)C=CNC1=S |
Product Overview
甲硫氧嘧啶 (CAS 56-04-2), with molecular formula C5H6N2OS and molecular weight 142.02 g/mol. IUPAC: 3-methyl-2-sulfanylidene-1H-pyrimidin-4-one.
Chemical Property Profile of 甲硫氧嘧啶
Property Insights of 甲硫氧嘧啶
The XLogP value of 0.44289 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 甲硫氧嘧啶. With a topological polar surface area (TPSA) of 37.79 Ų, 甲硫氧嘧啶 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 甲硫氧嘧啶 has 1 hydrogen bond donor(s) and 2 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 甲硫氧嘧啶?
The CAS number of 甲硫氧嘧啶 is 56-04-2.
What is the molecular formula of 甲硫氧嘧啶?
The molecular formula of 甲硫氧嘧啶 is C5H6N2OS.
What is the molecular weight of 甲硫氧嘧啶?
The molecular weight of 甲硫氧嘧啶 is 142.02 g/mol.
Where can I buy 甲硫氧嘧啶?
You can request a quote for 甲硫氧嘧啶 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 甲硫氧嘧啶?
Yes, KEHONG BIO provides custom synthesis services for 甲硫氧嘧啶 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.