Barbituric acid, 5-acetonyl-5-allyl-, 5-hydrazone
TL;DR: Barbituric acid, 5-acetonyl-5-allyl-, 5-hydrazone (CAS 20959-20-0) is a chemical compound with molecular formula C10H14N4O3 and molecular weight 238.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2E)-2-hydrazinylidenepropyl]-5-prop-2-enyl-1,3-diazinane-2,4,6-trione
Also Known As: Hydrazone of 5-allyl-5-acetonylbarbituric acid, 5-Allyl-5-(2-oxopropyl)barbituric acid 5-hydrazone, BARBITURIC ACID, 5-ACETONYL-5-ALLYL-, 5-HYDRAZONE, RefChem:1077603, BRN 0665521
| Molecular Formula | C10H14N4O3 |
|---|---|
| Molecular Weight | 238.11 g/mol |
| LogP | -0.3604 |
| Topological Polar Surface Area | 113.65 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 238.1066 |
| Heavy Atoms | 17 |
| Complexity | 393.77408 |
Chemical Identifiers
| CAS Number | 20959-20-0 |
|---|---|
| SMILES | C/C(=N\N)/CC1(C(=O)NC(=O)NC1=O)CC=C |
Product Overview
Barbituric acid, 5-acetonyl-5-allyl-, 5-hydrazone (CAS 20959-20-0), with molecular formula C10H14N4O3 and molecular weight 238.11 g/mol. IUPAC: 5-[(2E)-2-hydrazinylidenepropyl]-5-prop-2-enyl-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of Barbituric acid, 5-acetonyl-5-allyl-, 5-hydrazone
Property Insights of Barbituric acid, 5-acetonyl-5-allyl-, 5-hydrazone
The XLogP value of -0.3604 indicates that Barbituric acid, 5-acetonyl-5-allyl-, 5-hydrazone is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 113.65 Ų falls within the moderate polarity range, balancing permeability and solubility for Barbituric acid, 5-acetonyl-5-allyl-, 5-hydrazone. Following Lipinski's Rule of Five, Barbituric acid, 5-acetonyl-5-allyl-, 5-hydrazone has 3 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-acetonyl-5-allyl-, 5-hydrazone?
The CAS number of Barbituric acid, 5-acetonyl-5-allyl-, 5-hydrazone is 20959-20-0.
What is the molecular formula of Barbituric acid, 5-acetonyl-5-allyl-, 5-hydrazone?
The molecular formula of Barbituric acid, 5-acetonyl-5-allyl-, 5-hydrazone is C10H14N4O3.
What is the molecular weight of Barbituric acid, 5-acetonyl-5-allyl-, 5-hydrazone?
The molecular weight of Barbituric acid, 5-acetonyl-5-allyl-, 5-hydrazone is 238.11 g/mol.
Where can I buy Barbituric acid, 5-acetonyl-5-allyl-, 5-hydrazone?
You can request a quote for Barbituric acid, 5-acetonyl-5-allyl-, 5-hydrazone 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-acetonyl-5-allyl-, 5-hydrazone?
Yes, KEHONG BIO provides custom synthesis services for Barbituric acid, 5-acetonyl-5-allyl-, 5-hydrazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.