Barbituric acid, 1-(p-chlorophenyl)-5-(2-(diethylamino)ethyl)-2-thio-
TL;DR: Barbituric acid, 1-(p-chlorophenyl)-5-(2-(diethylamino)ethyl)-2-thio- (CAS 93017-59-5) is a chemical compound with molecular formula C16H20ClN3O2S and molecular weight 353.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-5-[2-(diethylamino)ethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: 5-25-16-00098 (Beilstein Handbook Reference), 1-(p-Chlorophenyl)-5-(2-(diethylamino)ethyl)-2-thiobarbituric acid, BARBITURIC ACID, 1-(p-CHLOROPHENYL)-5-(2-(DIETHYLAMINO)ETHYL)-2-THIO-, 1-(4-chlorophenyl)-5-(2-diethylaminoethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione, 1-(4-chlorophenyl)-5-[2-(diethylamino)ethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione
| Molecular Formula | C16H20ClN3O2S |
|---|---|
| Molecular Weight | 353.10 g/mol |
| LogP | 2.4358 |
| Topological Polar Surface Area | 52.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 353.09647 |
| Heavy Atoms | 23 |
| Complexity | 601.84784 |
Chemical Identifiers
| CAS Number | 93017-59-5 |
|---|---|
| SMILES | CCN(CC)CCC1C(=O)NC(=S)N(C1=O)C2=CC=C(C=C2)Cl |
Product Overview
Barbituric acid, 1-(p-chlorophenyl)-5-(2-(diethylamino)ethyl)-2-thio- (CAS 93017-59-5), with molecular formula C16H20ClN3O2S and molecular weight 353.10 g/mol. IUPAC: 1-(4-chlorophenyl)-5-[2-(diethylamino)ethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of Barbituric acid, 1-(p-chlorophenyl)-5-(2-(diethylamino)ethyl)-2-thio-
Property Insights of Barbituric acid, 1-(p-chlorophenyl)-5-(2-(diethylamino)ethyl)-2-thio-
The XLogP value of 2.4358 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Barbituric acid, 1-(p-chlorophenyl)-5-(2-(diethylamino)ethyl)-2-thio-. With a topological polar surface area (TPSA) of 52.65 Ų, Barbituric acid, 1-(p-chlorophenyl)-5-(2-(diethylamino)ethyl)-2-thio- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Barbituric acid, 1-(p-chlorophenyl)-5-(2-(diethylamino)ethyl)-2-thio- has 1 hydrogen bond donor(s) and 4 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, 1-(p-chlorophenyl)-5-(2-(diethylamino)ethyl)-2-thio-?
The CAS number of Barbituric acid, 1-(p-chlorophenyl)-5-(2-(diethylamino)ethyl)-2-thio- is 93017-59-5.
What is the molecular formula of Barbituric acid, 1-(p-chlorophenyl)-5-(2-(diethylamino)ethyl)-2-thio-?
The molecular formula of Barbituric acid, 1-(p-chlorophenyl)-5-(2-(diethylamino)ethyl)-2-thio- is C16H20ClN3O2S.
What is the molecular weight of Barbituric acid, 1-(p-chlorophenyl)-5-(2-(diethylamino)ethyl)-2-thio-?
The molecular weight of Barbituric acid, 1-(p-chlorophenyl)-5-(2-(diethylamino)ethyl)-2-thio- is 353.10 g/mol.
Where can I buy Barbituric acid, 1-(p-chlorophenyl)-5-(2-(diethylamino)ethyl)-2-thio-?
You can request a quote for Barbituric acid, 1-(p-chlorophenyl)-5-(2-(diethylamino)ethyl)-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, 1-(p-chlorophenyl)-5-(2-(diethylamino)ethyl)-2-thio-?
Yes, KEHONG BIO provides custom synthesis services for Barbituric acid, 1-(p-chlorophenyl)-5-(2-(diethylamino)ethyl)-2-thio- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.