5-(2-(Dimethylamino)ethyl)-1-(p-ethoxyphenyl)-2-thiobarbituric acid
TL;DR: 5-(2-(Dimethylamino)ethyl)-1-(p-ethoxyphenyl)-2-thiobarbituric acid (CAS 93150-46-0) is a chemical compound with molecular formula C16H21N3O3S and molecular weight 335.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[2-(dimethylamino)ethyl]-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: 5-25-16-00098 (Beilstein Handbook Reference), 5-(2-(Dimethylamino)ethyl)-1-(p-ethoxyphenyl)-2-thiobarbituric acid, BARBITURIC ACID, 5-(2-(DIMETHYLAMINO)ETHYL)-1-(p-ETHOXYPHENYL)-2-THIO-, 5-(2-dimethylaminoethyl)-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione, 5-[2-(dimethylamino)ethyl]-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
| Molecular Formula | C16H21N3O3S |
|---|---|
| Molecular Weight | 335.13 g/mol |
| LogP | 1.4009 |
| Topological Polar Surface Area | 61.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 335.13037 |
| Heavy Atoms | 23 |
| Complexity | 601.09296 |
Chemical Identifiers
| CAS Number | 93150-46-0 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=O)C(C(=O)NC2=S)CCN(C)C |
Product Overview
5-(2-(Dimethylamino)ethyl)-1-(p-ethoxyphenyl)-2-thiobarbituric acid (CAS 93150-46-0), with molecular formula C16H21N3O3S and molecular weight 335.13 g/mol. IUPAC: 5-[2-(dimethylamino)ethyl]-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of 5-(2-(Dimethylamino)ethyl)-1-(p-ethoxyphenyl)-2-thiobarbituric acid
Property Insights of 5-(2-(Dimethylamino)ethyl)-1-(p-ethoxyphenyl)-2-thiobarbituric acid
The XLogP value of 1.4009 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2-(Dimethylamino)ethyl)-1-(p-ethoxyphenyl)-2-thiobarbituric acid. The TPSA of 61.88 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(2-(Dimethylamino)ethyl)-1-(p-ethoxyphenyl)-2-thiobarbituric acid. Following Lipinski's Rule of Five, 5-(2-(Dimethylamino)ethyl)-1-(p-ethoxyphenyl)-2-thiobarbituric acid has 1 hydrogen bond donor(s) and 5 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-(2-(Dimethylamino)ethyl)-1-(p-ethoxyphenyl)-2-thiobarbituric acid?
The CAS number of 5-(2-(Dimethylamino)ethyl)-1-(p-ethoxyphenyl)-2-thiobarbituric acid is 93150-46-0.
What is the molecular formula of 5-(2-(Dimethylamino)ethyl)-1-(p-ethoxyphenyl)-2-thiobarbituric acid?
The molecular formula of 5-(2-(Dimethylamino)ethyl)-1-(p-ethoxyphenyl)-2-thiobarbituric acid is C16H21N3O3S.
What is the molecular weight of 5-(2-(Dimethylamino)ethyl)-1-(p-ethoxyphenyl)-2-thiobarbituric acid?
The molecular weight of 5-(2-(Dimethylamino)ethyl)-1-(p-ethoxyphenyl)-2-thiobarbituric acid is 335.13 g/mol.
Where can I buy 5-(2-(Dimethylamino)ethyl)-1-(p-ethoxyphenyl)-2-thiobarbituric acid?
You can request a quote for 5-(2-(Dimethylamino)ethyl)-1-(p-ethoxyphenyl)-2-thiobarbituric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2-(Dimethylamino)ethyl)-1-(p-ethoxyphenyl)-2-thiobarbituric acid?
Yes, KEHONG BIO provides custom synthesis services for 5-(2-(Dimethylamino)ethyl)-1-(p-ethoxyphenyl)-2-thiobarbituric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.