Barbituric acid, 1,3-dicyclohexyl-5-isobutyl-
TL;DR: Barbituric acid, 1,3-dicyclohexyl-5-isobutyl- (CAS 745-32-4) is a chemical compound with molecular formula C20H32N2O3 and molecular weight 348.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dicyclohexyl-5-(2-methylpropyl)-1,3-diazinane-2,4,6-trione
Also Known As: 1,3-Dicyclohexyl-5-isobutylbarbituric acid, BARBITURIC ACID, 1,3-DICYCLOHEXYL-5-ISOBUTYL-, 1,3-Dicyclohexyl-5-isobutylbarbituricacid, 5-24-09-00136 (Beilstein Handbook Reference), 1,3-Dicyclohexyl-5-isobutyl-2,4,6(1H,3H,5H)-pyrimidinetrione
| Molecular Formula | C20H32N2O3 |
|---|---|
| Molecular Weight | 348.24 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 57.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 348.2413 |
| Heavy Atoms | 25 |
| Complexity | 479.0 |
Chemical Identifiers
| CAS Number | 745-32-4 |
|---|---|
| SMILES | CC(C)CC1C(=O)N(C(=O)N(C1=O)C2CCCCC2)C3CCCCC3 |
| InChIKey | PEFJPFCZDCYQSO-UHFFFAOYSA-N |
Product Overview
Barbituric acid, 1,3-dicyclohexyl-5-isobutyl- (CAS 745-32-4), with molecular formula C20H32N2O3 and molecular weight 348.24 g/mol. IUPAC: 1,3-dicyclohexyl-5-(2-methylpropyl)-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of Barbituric acid, 1,3-dicyclohexyl-5-isobutyl-
Property Insights of Barbituric acid, 1,3-dicyclohexyl-5-isobutyl-
The XLogP value of 4.5 indicates that Barbituric acid, 1,3-dicyclohexyl-5-isobutyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.7 Ų, Barbituric acid, 1,3-dicyclohexyl-5-isobutyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Barbituric acid, 1,3-dicyclohexyl-5-isobutyl- has 0 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, 1,3-dicyclohexyl-5-isobutyl-?
The CAS number of Barbituric acid, 1,3-dicyclohexyl-5-isobutyl- is 745-32-4.
What is the molecular formula of Barbituric acid, 1,3-dicyclohexyl-5-isobutyl-?
The molecular formula of Barbituric acid, 1,3-dicyclohexyl-5-isobutyl- is C20H32N2O3.
What is the molecular weight of Barbituric acid, 1,3-dicyclohexyl-5-isobutyl-?
The molecular weight of Barbituric acid, 1,3-dicyclohexyl-5-isobutyl- is 348.24 g/mol.
Where can I buy Barbituric acid, 1,3-dicyclohexyl-5-isobutyl-?
You can request a quote for Barbituric acid, 1,3-dicyclohexyl-5-isobutyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Barbituric acid, 1,3-dicyclohexyl-5-isobutyl-?
Yes, KEHONG BIO provides custom synthesis services for Barbituric acid, 1,3-dicyclohexyl-5-isobutyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.