Barbituric acid, 5-(dimethylamino)-1-(p-ethoxyphenyl)-2-thio-
TL;DR: Barbituric acid, 5-(dimethylamino)-1-(p-ethoxyphenyl)-2-thio- (CAS 92440-56-7) is a chemical compound with molecular formula C14H17N3O3S and molecular weight 307.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(dimethylamino)-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: 5-(Dimethylamino)-1-(p-ethoxyphenyl)-2-thiobarbituric acid, 5-25-16-00095 (Beilstein Handbook Reference), BARBITURIC ACID, 5-(DIMETHYLAMINO)-1-(p-ETHOXYPHENYL)-2-THIO-, 5-(dimethylamino)-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione, 5-(Dimethylamino)-1-(p-ethoxyphenyl)-2-thioxo-2,3-dihydropyrimidine-4,6(1H,5H)-dione
| Molecular Formula | C14H17N3O3S |
|---|---|
| Molecular Weight | 307.10 g/mol |
| LogP | 0.7632 |
| Topological Polar Surface Area | 61.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 307.09906 |
| Heavy Atoms | 21 |
| Complexity | 571.3319 |
Chemical Identifiers
| CAS Number | 92440-56-7 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=O)C(C(=O)NC2=S)N(C)C |
Product Overview
Barbituric acid, 5-(dimethylamino)-1-(p-ethoxyphenyl)-2-thio- (CAS 92440-56-7), with molecular formula C14H17N3O3S and molecular weight 307.10 g/mol. IUPAC: 5-(dimethylamino)-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of Barbituric acid, 5-(dimethylamino)-1-(p-ethoxyphenyl)-2-thio-
Property Insights of Barbituric acid, 5-(dimethylamino)-1-(p-ethoxyphenyl)-2-thio-
The XLogP value of 0.7632 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Barbituric acid, 5-(dimethylamino)-1-(p-ethoxyphenyl)-2-thio-. The TPSA of 61.88 Ų falls within the moderate polarity range, balancing permeability and solubility for Barbituric acid, 5-(dimethylamino)-1-(p-ethoxyphenyl)-2-thio-. Following Lipinski's Rule of Five, Barbituric acid, 5-(dimethylamino)-1-(p-ethoxyphenyl)-2-thio- 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 Barbituric acid, 5-(dimethylamino)-1-(p-ethoxyphenyl)-2-thio-?
The CAS number of Barbituric acid, 5-(dimethylamino)-1-(p-ethoxyphenyl)-2-thio- is 92440-56-7.
What is the molecular formula of Barbituric acid, 5-(dimethylamino)-1-(p-ethoxyphenyl)-2-thio-?
The molecular formula of Barbituric acid, 5-(dimethylamino)-1-(p-ethoxyphenyl)-2-thio- is C14H17N3O3S.
What is the molecular weight of Barbituric acid, 5-(dimethylamino)-1-(p-ethoxyphenyl)-2-thio-?
The molecular weight of Barbituric acid, 5-(dimethylamino)-1-(p-ethoxyphenyl)-2-thio- is 307.10 g/mol.
Where can I buy Barbituric acid, 5-(dimethylamino)-1-(p-ethoxyphenyl)-2-thio-?
You can request a quote for Barbituric acid, 5-(dimethylamino)-1-(p-ethoxyphenyl)-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-(dimethylamino)-1-(p-ethoxyphenyl)-2-thio-?
Yes, KEHONG BIO provides custom synthesis services for Barbituric acid, 5-(dimethylamino)-1-(p-ethoxyphenyl)-2-thio- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.