美沙拉妥
TL;DR: 美沙拉妥 (CAS 115-56-0) is a chemical compound with molecular formula C10H14N2O2S and molecular weight 226.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
美沙拉妥
5-ethyl-5-(2-methylprop-2-enyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: METHALLATAL, Mosidal, METHALLATAL [MI], EINECS 204-095-1, 5-Ethyl-5-(2-methylallyl)-2-thiobarbituric acid
| Molecular Formula | C10H14N2O2S |
|---|---|
| Molecular Weight | 226.08 g/mol |
| LogP | 0.8799 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 226.0776 |
| Heavy Atoms | 15 |
| Complexity | 329.33154 |
Chemical Identifiers
| CAS Number | 115-56-0 |
|---|---|
| SMILES | CCC1(C(=O)NC(=S)NC1=O)CC(=C)C |
Product Overview
美沙拉妥 (CAS 115-56-0), with molecular formula C10H14N2O2S and molecular weight 226.08 g/mol. IUPAC: 5-ethyl-5-(2-methylprop-2-enyl)-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of 美沙拉妥
Property Insights of 美沙拉妥
The XLogP value of 0.8799 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 美沙拉妥. With a topological polar surface area (TPSA) of 58.2 Ų, 美沙拉妥 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 美沙拉妥 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 美沙拉妥?
The CAS number of 美沙拉妥 is 115-56-0.
What is the molecular formula of 美沙拉妥?
The molecular formula of 美沙拉妥 is C10H14N2O2S.
What is the molecular weight of 美沙拉妥?
The molecular weight of 美沙拉妥 is 226.08 g/mol.
Where can I buy 美沙拉妥?
You can request a quote for 美沙拉妥 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 美沙拉妥?
Yes, KEHONG BIO provides custom synthesis services for 美沙拉妥 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.