5-(2-Hydroxybutyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione
TL;DR: 5-(2-Hydroxybutyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione (CAS 66941-78-4) is a chemical compound with molecular formula C11H16N2O4 and molecular weight 240.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-hydroxybutyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione
Also Known As: 5-(2-hydroxybutyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione, BARBITURIC ACID, 5-ALLYL-5-(2-METHYLBUTYL)-, 5-(2-Hydroxybutyl)-5-(prop-2-en-1-yl)-1,3-diazinane-2,4,6-trione
| Molecular Formula | C11H16N2O4 |
|---|---|
| Molecular Weight | 240.11 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 95.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 240.11101 |
| Heavy Atoms | 17 |
| Complexity | 344.0 |
Chemical Identifiers
| CAS Number | 66941-78-4 |
|---|---|
| SMILES | CCC(CC1(C(=O)NC(=O)NC1=O)CC=C)O |
| InChIKey | UFJFENQSZYKNSF-UHFFFAOYSA-N |
Product Overview
5-(2-Hydroxybutyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione (CAS 66941-78-4), with molecular formula C11H16N2O4 and molecular weight 240.11 g/mol. IUPAC: 5-(2-hydroxybutyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 5-(2-Hydroxybutyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione
Property Insights of 5-(2-Hydroxybutyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2-Hydroxybutyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione. The TPSA of 95.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(2-Hydroxybutyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, 5-(2-Hydroxybutyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione has 3 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 5-(2-Hydroxybutyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione?
The CAS number of 5-(2-Hydroxybutyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione is 66941-78-4.
What is the molecular formula of 5-(2-Hydroxybutyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione?
The molecular formula of 5-(2-Hydroxybutyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione is C11H16N2O4.
What is the molecular weight of 5-(2-Hydroxybutyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione?
The molecular weight of 5-(2-Hydroxybutyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione is 240.11 g/mol.
Where can I buy 5-(2-Hydroxybutyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione?
You can request a quote for 5-(2-Hydroxybutyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2-Hydroxybutyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for 5-(2-Hydroxybutyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.