5-Hexylaminomethylene-1,3-dimethyl-pyrimidine-2,4,6-trione
TL;DR: 5-Hexylaminomethylene-1,3-dimethyl-pyrimidine-2,4,6-trione (CAS 5311-65-9) is a chemical compound with molecular formula C13H21N3O3 and molecular weight 267.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(hexyliminomethyl)-6-hydroxy-1,3-dimethylpyrimidine-2,4-dione
Also Known As: BAS 00639597, 5-Hexylaminomethylene-1,3-dimethyl-pyrimidine-2,4,6-trione, 5-[(hexylamino)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione, 5-[(Hexylamino)methylene]-1,3-dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione, 5-(hexyliminomethyl)-6-hydroxy-1,3-dimethylpyrimidine-2,4-dione
| Molecular Formula | C13H21N3O3 |
|---|---|
| Molecular Weight | 267.16 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 73.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 267.1583 |
| Heavy Atoms | 19 |
| Complexity | 415.0 |
Chemical Identifiers
| CAS Number | 5311-65-9 |
|---|---|
| SMILES | CCCCCCN=CC1=C(N(C(=O)N(C1=O)C)C)O |
| InChIKey | ZDUAUUMEYMWZSW-UHFFFAOYSA-N |
Product Overview
5-Hexylaminomethylene-1,3-dimethyl-pyrimidine-2,4,6-trione (CAS 5311-65-9), with molecular formula C13H21N3O3 and molecular weight 267.16 g/mol. IUPAC: 5-(hexyliminomethyl)-6-hydroxy-1,3-dimethylpyrimidine-2,4-dione.
Chemical Property Profile of 5-Hexylaminomethylene-1,3-dimethyl-pyrimidine-2,4,6-trione
Property Insights of 5-Hexylaminomethylene-1,3-dimethyl-pyrimidine-2,4,6-trione
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Hexylaminomethylene-1,3-dimethyl-pyrimidine-2,4,6-trione. The TPSA of 73.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Hexylaminomethylene-1,3-dimethyl-pyrimidine-2,4,6-trione. Following Lipinski's Rule of Five, 5-Hexylaminomethylene-1,3-dimethyl-pyrimidine-2,4,6-trione has 1 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-Hexylaminomethylene-1,3-dimethyl-pyrimidine-2,4,6-trione?
The CAS number of 5-Hexylaminomethylene-1,3-dimethyl-pyrimidine-2,4,6-trione is 5311-65-9.
What is the molecular formula of 5-Hexylaminomethylene-1,3-dimethyl-pyrimidine-2,4,6-trione?
The molecular formula of 5-Hexylaminomethylene-1,3-dimethyl-pyrimidine-2,4,6-trione is C13H21N3O3.
What is the molecular weight of 5-Hexylaminomethylene-1,3-dimethyl-pyrimidine-2,4,6-trione?
The molecular weight of 5-Hexylaminomethylene-1,3-dimethyl-pyrimidine-2,4,6-trione is 267.16 g/mol.
Where can I buy 5-Hexylaminomethylene-1,3-dimethyl-pyrimidine-2,4,6-trione?
You can request a quote for 5-Hexylaminomethylene-1,3-dimethyl-pyrimidine-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-Hexylaminomethylene-1,3-dimethyl-pyrimidine-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for 5-Hexylaminomethylene-1,3-dimethyl-pyrimidine-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.