5-Ethyl-4,6-dihydroxy-5-(3-methylbut-2-en-1-yl)pyrimidine-2(5H)-thione
TL;DR: 5-Ethyl-4,6-dihydroxy-5-(3-methylbut-2-en-1-yl)pyrimidine-2(5H)-thione (CAS 66968-74-9) is a chemical compound with molecular formula C11H16N2O2S and molecular weight 240.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethyl-5-(3-methylbut-2-enyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: 5-Ethyl-5-(3-methyl-2-butenyl)-2-thiobarbituric acid, 4-24-00-02001 (Beilstein Handbook Reference), BARBITURIC ACID, 5-ETHYL-5-(3-METHYL-2-BUTENYL)-2-THIO-, Acide 5-(gamma,gamma-dimethyl-allyl) 5-ethyl thio-barbiturique [French], 5-ethyl-2,3-dihydro-5-2-thioxo-4,6 -pyrimidinedione
| Molecular Formula | C11H16N2O2S |
|---|---|
| Molecular Weight | 240.09 g/mol |
| LogP | 1.27 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 240.09325 |
| Heavy Atoms | 16 |
| Complexity | 350.18085 |
Chemical Identifiers
| CAS Number | 66968-74-9 |
|---|---|
| SMILES | CCC1(C(=O)NC(=S)NC1=O)CC=C(C)C |
Product Overview
5-Ethyl-4,6-dihydroxy-5-(3-methylbut-2-en-1-yl)pyrimidine-2(5H)-thione (CAS 66968-74-9), with molecular formula C11H16N2O2S and molecular weight 240.09 g/mol. IUPAC: 5-ethyl-5-(3-methylbut-2-enyl)-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of 5-Ethyl-4,6-dihydroxy-5-(3-methylbut-2-en-1-yl)pyrimidine-2(5H)-thione
Property Insights of 5-Ethyl-4,6-dihydroxy-5-(3-methylbut-2-en-1-yl)pyrimidine-2(5H)-thione
The XLogP value of 1.27 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Ethyl-4,6-dihydroxy-5-(3-methylbut-2-en-1-yl)pyrimidine-2(5H)-thione. With a topological polar surface area (TPSA) of 58.2 Ų, 5-Ethyl-4,6-dihydroxy-5-(3-methylbut-2-en-1-yl)pyrimidine-2(5H)-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Ethyl-4,6-dihydroxy-5-(3-methylbut-2-en-1-yl)pyrimidine-2(5H)-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 5-Ethyl-4,6-dihydroxy-5-(3-methylbut-2-en-1-yl)pyrimidine-2(5H)-thione?
The CAS number of 5-Ethyl-4,6-dihydroxy-5-(3-methylbut-2-en-1-yl)pyrimidine-2(5H)-thione is 66968-74-9.
What is the molecular formula of 5-Ethyl-4,6-dihydroxy-5-(3-methylbut-2-en-1-yl)pyrimidine-2(5H)-thione?
The molecular formula of 5-Ethyl-4,6-dihydroxy-5-(3-methylbut-2-en-1-yl)pyrimidine-2(5H)-thione is C11H16N2O2S.
What is the molecular weight of 5-Ethyl-4,6-dihydroxy-5-(3-methylbut-2-en-1-yl)pyrimidine-2(5H)-thione?
The molecular weight of 5-Ethyl-4,6-dihydroxy-5-(3-methylbut-2-en-1-yl)pyrimidine-2(5H)-thione is 240.09 g/mol.
Where can I buy 5-Ethyl-4,6-dihydroxy-5-(3-methylbut-2-en-1-yl)pyrimidine-2(5H)-thione?
You can request a quote for 5-Ethyl-4,6-dihydroxy-5-(3-methylbut-2-en-1-yl)pyrimidine-2(5H)-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Ethyl-4,6-dihydroxy-5-(3-methylbut-2-en-1-yl)pyrimidine-2(5H)-thione?
Yes, KEHONG BIO provides custom synthesis services for 5-Ethyl-4,6-dihydroxy-5-(3-methylbut-2-en-1-yl)pyrimidine-2(5H)-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.