1-4-Dimethylaminophenyl-5-allyl-5-(beta-hydroxypropyl)barbituric acid
TL;DR: 1-4-Dimethylaminophenyl-5-allyl-5-(beta-hydroxypropyl)barbituric acid (CAS 33074-61-2) is a chemical compound with molecular formula C18H23N3O4 and molecular weight 345.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(dimethylamino)phenyl]-5-(2-hydroxypropyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione
Also Known As: 2,5-Diphenyl-3,4-dihydro-3-furanon, 5-25-03-00296 (Beilstein Handbook Reference), 1-4-Dimethylaminophenyl-5-allyl-5-(beta-hydroxypropyl)barbituric acid, 1-p-Dimethylaminophenyl-5-allyl-5-(beta-hydroxypropyl)barbituric acid, 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-(4-(dimethylamino)phenyl)-5-(2-hydroxypropyl)-5-(2-propenyl)-
| Molecular Formula | C18H23N3O4 |
|---|---|
| Molecular Weight | 345.17 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 90.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 345.16885 |
| Heavy Atoms | 25 |
| Complexity | 555.0 |
Chemical Identifiers
| CAS Number | 33074-61-2 |
|---|---|
| SMILES | CC(CC1(C(=O)NC(=O)N(C1=O)C2=CC=C(C=C2)N(C)C)CC=C)O |
| InChIKey | WLTCFWIYQHMPBR-UHFFFAOYSA-N |
Product Overview
1-4-Dimethylaminophenyl-5-allyl-5-(beta-hydroxypropyl)barbituric acid (CAS 33074-61-2), with molecular formula C18H23N3O4 and molecular weight 345.17 g/mol. IUPAC: 1-[4-(dimethylamino)phenyl]-5-(2-hydroxypropyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 1-4-Dimethylaminophenyl-5-allyl-5-(beta-hydroxypropyl)barbituric acid
Property Insights of 1-4-Dimethylaminophenyl-5-allyl-5-(beta-hydroxypropyl)barbituric acid
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-4-Dimethylaminophenyl-5-allyl-5-(beta-hydroxypropyl)barbituric acid. The TPSA of 90.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-4-Dimethylaminophenyl-5-allyl-5-(beta-hydroxypropyl)barbituric acid. Following Lipinski's Rule of Five, 1-4-Dimethylaminophenyl-5-allyl-5-(beta-hydroxypropyl)barbituric acid 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 1-4-Dimethylaminophenyl-5-allyl-5-(beta-hydroxypropyl)barbituric acid?
The CAS number of 1-4-Dimethylaminophenyl-5-allyl-5-(beta-hydroxypropyl)barbituric acid is 33074-61-2.
What is the molecular formula of 1-4-Dimethylaminophenyl-5-allyl-5-(beta-hydroxypropyl)barbituric acid?
The molecular formula of 1-4-Dimethylaminophenyl-5-allyl-5-(beta-hydroxypropyl)barbituric acid is C18H23N3O4.
What is the molecular weight of 1-4-Dimethylaminophenyl-5-allyl-5-(beta-hydroxypropyl)barbituric acid?
The molecular weight of 1-4-Dimethylaminophenyl-5-allyl-5-(beta-hydroxypropyl)barbituric acid is 345.17 g/mol.
Where can I buy 1-4-Dimethylaminophenyl-5-allyl-5-(beta-hydroxypropyl)barbituric acid?
You can request a quote for 1-4-Dimethylaminophenyl-5-allyl-5-(beta-hydroxypropyl)barbituric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-4-Dimethylaminophenyl-5-allyl-5-(beta-hydroxypropyl)barbituric acid?
Yes, KEHONG BIO provides custom synthesis services for 1-4-Dimethylaminophenyl-5-allyl-5-(beta-hydroxypropyl)barbituric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.