5,5-Diethyl-1,3-diphenyl-2-iminobarbituric Acid
TL;DR: 5,5-Diethyl-1,3-diphenyl-2-iminobarbituric Acid (CAS 200116-26-3) is a chemical compound with molecular formula C20H21N3O2 and molecular weight 335.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5-diethyl-2-imino-1,3-diphenyl-1,3-diazinane-4,6-dione
Also Known As: 5,5-Diethyl-1,3-diphenyl-2-iminobarbituric Acid, NCIOpen2_009499, 5,5-diethyl-2-imino-1,3-diphenyl-1,3-diazinane-4,6-dione, 5,5-diethyl-2-imino-1,3-diphenyldihydropyrimidine-4,6(1h,5h)-dione, 5,5-Diethyldihydro-2-imino-1,3-diphenyl-4,6(1H,5H)-pyrimidinedione
| Molecular Formula | C20H21N3O2 |
|---|---|
| Molecular Weight | 335.16 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 64.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 335.1634 |
| Heavy Atoms | 25 |
| Complexity | 487.0 |
Chemical Identifiers
| CAS Number | 200116-26-3 |
|---|---|
| SMILES | CCC1(C(=O)N(C(=N)N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)CC |
| InChIKey | UOVOTAJFAYMIHH-UHFFFAOYSA-N |
Product Overview
5,5-Diethyl-1,3-diphenyl-2-iminobarbituric Acid (CAS 200116-26-3), with molecular formula C20H21N3O2 and molecular weight 335.16 g/mol. IUPAC: 5,5-diethyl-2-imino-1,3-diphenyl-1,3-diazinane-4,6-dione.
Chemical Property Profile of 5,5-Diethyl-1,3-diphenyl-2-iminobarbituric Acid
Property Insights of 5,5-Diethyl-1,3-diphenyl-2-iminobarbituric Acid
The XLogP value of 4.1 indicates that 5,5-Diethyl-1,3-diphenyl-2-iminobarbituric Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,5-Diethyl-1,3-diphenyl-2-iminobarbituric Acid. Following Lipinski's Rule of Five, 5,5-Diethyl-1,3-diphenyl-2-iminobarbituric Acid has 1 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 5,5-Diethyl-1,3-diphenyl-2-iminobarbituric Acid?
The CAS number of 5,5-Diethyl-1,3-diphenyl-2-iminobarbituric Acid is 200116-26-3.
What is the molecular formula of 5,5-Diethyl-1,3-diphenyl-2-iminobarbituric Acid?
The molecular formula of 5,5-Diethyl-1,3-diphenyl-2-iminobarbituric Acid is C20H21N3O2.
What is the molecular weight of 5,5-Diethyl-1,3-diphenyl-2-iminobarbituric Acid?
The molecular weight of 5,5-Diethyl-1,3-diphenyl-2-iminobarbituric Acid is 335.16 g/mol.
Where can I buy 5,5-Diethyl-1,3-diphenyl-2-iminobarbituric Acid?
You can request a quote for 5,5-Diethyl-1,3-diphenyl-2-iminobarbituric Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,5-Diethyl-1,3-diphenyl-2-iminobarbituric Acid?
Yes, KEHONG BIO provides custom synthesis services for 5,5-Diethyl-1,3-diphenyl-2-iminobarbituric Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.