Barbituric acid, 5,5-diallyl-2-thio-
TL;DR: Barbituric acid, 5,5-diallyl-2-thio- (CAS 35242-32-1) is a chemical compound with molecular formula C10H12N2O2S and molecular weight 224.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5-bis(prop-2-enyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: Barbituric acid, 5,5-diallyl-2-thio-, 5-24-09-00251 (Beilstein Handbook Reference), 4,6(1H,5H)-Pyrimidinedione, dihydro-5,5-di-2-propenyl-2-thioxo-, 5,5-bis(prop-2-enyl)-2-sulfanylidene-1,3-diazinane-4,6-dione, 5,5-Di(prop-2-en-1-yl)-2-sulfanylidene-1,3-diazinane-4,6-dione
| Molecular Formula | C10H12N2O2S |
|---|---|
| Molecular Weight | 224.06 g/mol |
| LogP | 0.6559 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 224.06195 |
| Heavy Atoms | 15 |
| Complexity | 317.33154 |
Chemical Identifiers
| CAS Number | 35242-32-1 |
|---|---|
| SMILES | C=CCC1(C(=O)NC(=S)NC1=O)CC=C |
Product Overview
Barbituric acid, 5,5-diallyl-2-thio- (CAS 35242-32-1), with molecular formula C10H12N2O2S and molecular weight 224.06 g/mol. IUPAC: 5,5-bis(prop-2-enyl)-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of Barbituric acid, 5,5-diallyl-2-thio-
Property Insights of Barbituric acid, 5,5-diallyl-2-thio-
The XLogP value of 0.6559 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Barbituric acid, 5,5-diallyl-2-thio-. With a topological polar surface area (TPSA) of 58.2 Ų, Barbituric acid, 5,5-diallyl-2-thio- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Barbituric acid, 5,5-diallyl-2-thio- 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 Barbituric acid, 5,5-diallyl-2-thio-?
The CAS number of Barbituric acid, 5,5-diallyl-2-thio- is 35242-32-1.
What is the molecular formula of Barbituric acid, 5,5-diallyl-2-thio-?
The molecular formula of Barbituric acid, 5,5-diallyl-2-thio- is C10H12N2O2S.
What is the molecular weight of Barbituric acid, 5,5-diallyl-2-thio-?
The molecular weight of Barbituric acid, 5,5-diallyl-2-thio- is 224.06 g/mol.
Where can I buy Barbituric acid, 5,5-diallyl-2-thio-?
You can request a quote for Barbituric acid, 5,5-diallyl-2-thio- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Barbituric acid, 5,5-diallyl-2-thio-?
Yes, KEHONG BIO provides custom synthesis services for Barbituric acid, 5,5-diallyl-2-thio- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.