5-(Hexan-2-yl)-6-hydroxy-3-methyl-5-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione
TL;DR: 5-(Hexan-2-yl)-6-hydroxy-3-methyl-5-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione (CAS 66941-79-5) is a chemical compound with molecular formula C14H22N2O3 and molecular weight 266.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-hexan-2-yl-1-methyl-5-prop-2-enyl-1,3-diazinane-2,4,6-trione
Also Known As: 5-Allyl-1-methyl-5- barbituricacid, 5-Allyl-1-methyl-5-(1-methylpentyl)barbituric acid, BARBITURIC ACID, 5-ALLYL-1-METHYL-5-(1-METHYLPENTYL)-, 5-(Hexan-2-yl)-6-hydroxy-3-methyl-5-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione, 5-hexan-2-yl-1-methyl-5-prop-2-enyl-1,3-diazinane-2,4,6-trione
| Molecular Formula | C14H22N2O3 |
|---|---|
| Molecular Weight | 266.16 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 66.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 266.16306 |
| Heavy Atoms | 19 |
| Complexity | 405.0 |
Chemical Identifiers
| CAS Number | 66941-79-5 |
|---|---|
| SMILES | CCCCC(C)C1(C(=O)NC(=O)N(C1=O)C)CC=C |
| InChIKey | SHXBLYBYEGWNLH-UHFFFAOYSA-N |
Product Overview
5-(Hexan-2-yl)-6-hydroxy-3-methyl-5-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione (CAS 66941-79-5), with molecular formula C14H22N2O3 and molecular weight 266.16 g/mol. IUPAC: 5-hexan-2-yl-1-methyl-5-prop-2-enyl-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 5-(Hexan-2-yl)-6-hydroxy-3-methyl-5-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione
Property Insights of 5-(Hexan-2-yl)-6-hydroxy-3-methyl-5-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione
The XLogP value of 3.4 indicates that 5-(Hexan-2-yl)-6-hydroxy-3-methyl-5-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(Hexan-2-yl)-6-hydroxy-3-methyl-5-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione. Following Lipinski's Rule of Five, 5-(Hexan-2-yl)-6-hydroxy-3-methyl-5-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione has 1 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 5-(Hexan-2-yl)-6-hydroxy-3-methyl-5-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione?
The CAS number of 5-(Hexan-2-yl)-6-hydroxy-3-methyl-5-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione is 66941-79-5.
What is the molecular formula of 5-(Hexan-2-yl)-6-hydroxy-3-methyl-5-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione?
The molecular formula of 5-(Hexan-2-yl)-6-hydroxy-3-methyl-5-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione is C14H22N2O3.
What is the molecular weight of 5-(Hexan-2-yl)-6-hydroxy-3-methyl-5-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione?
The molecular weight of 5-(Hexan-2-yl)-6-hydroxy-3-methyl-5-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione is 266.16 g/mol.
Where can I buy 5-(Hexan-2-yl)-6-hydroxy-3-methyl-5-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione?
You can request a quote for 5-(Hexan-2-yl)-6-hydroxy-3-methyl-5-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Hexan-2-yl)-6-hydroxy-3-methyl-5-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-(Hexan-2-yl)-6-hydroxy-3-methyl-5-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.