Barbituric acid, 5-allyl-5-piperonyl-
TL;DR: Barbituric acid, 5-allyl-5-piperonyl- (CAS 69353-38-4) is a chemical compound with molecular formula C15H14N2O5 and molecular weight 302.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(1,3-benzodioxol-5-ylmethyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione
Also Known As: Piperonylallylbarbituric acid, 5-Allyl-5-piperonylbarbituricacid, BARBITURIC ACID, 5-ALLYL-5-PIPERONYL-, 5-Allyl-5-piperonylbarbituric acid, Allyl(3,4-methylenedioxybenzyl)barbituric acid
| Molecular Formula | C15H14N2O5 |
|---|---|
| Molecular Weight | 302.09 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 93.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 302.09027 |
| Heavy Atoms | 22 |
| Complexity | 498.0 |
Chemical Identifiers
| CAS Number | 69353-38-4 |
|---|---|
| SMILES | C=CCC1(C(=O)NC(=O)NC1=O)CC2=CC3=C(C=C2)OCO3 |
| InChIKey | DOIXCQCZFWKGLM-UHFFFAOYSA-N |
Product Overview
Barbituric acid, 5-allyl-5-piperonyl- (CAS 69353-38-4), with molecular formula C15H14N2O5 and molecular weight 302.09 g/mol. IUPAC: 5-(1,3-benzodioxol-5-ylmethyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of Barbituric acid, 5-allyl-5-piperonyl-
Property Insights of Barbituric acid, 5-allyl-5-piperonyl-
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Barbituric acid, 5-allyl-5-piperonyl-. The TPSA of 93.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Barbituric acid, 5-allyl-5-piperonyl-. Following Lipinski's Rule of Five, Barbituric acid, 5-allyl-5-piperonyl- has 2 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-allyl-5-piperonyl-?
The CAS number of Barbituric acid, 5-allyl-5-piperonyl- is 69353-38-4.
What is the molecular formula of Barbituric acid, 5-allyl-5-piperonyl-?
The molecular formula of Barbituric acid, 5-allyl-5-piperonyl- is C15H14N2O5.
What is the molecular weight of Barbituric acid, 5-allyl-5-piperonyl-?
The molecular weight of Barbituric acid, 5-allyl-5-piperonyl- is 302.09 g/mol.
Where can I buy Barbituric acid, 5-allyl-5-piperonyl-?
You can request a quote for Barbituric acid, 5-allyl-5-piperonyl- 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-allyl-5-piperonyl-?
Yes, KEHONG BIO provides custom synthesis services for Barbituric acid, 5-allyl-5-piperonyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.