5-(Aminomethylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione
TL;DR: 5-(Aminomethylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione (CAS 90000-82-1) is a chemical compound with molecular formula C7H9N3O3 and molecular weight 183.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-hydroxy-5-methanimidoyl-1,3-dimethylpyrimidine-2,4-dione
Also Known As: 5-(aminomethylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione, NCI60_004268, 5-(AMINOMETHYLENE)-1,3-DIMETHYLPYRIMIDINE-2,4,6(1H,3H,5H)-TRIONE
| Molecular Formula | C7H9N3O3 |
|---|---|
| Molecular Weight | 183.06 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 84.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 183.06439 |
| Heavy Atoms | 13 |
| Complexity | 321.0 |
Chemical Identifiers
| CAS Number | 90000-82-1 |
|---|---|
| SMILES | CN1C(=C(C(=O)N(C1=O)C)C=N)O |
| InChIKey | PSQJBLXBXDAINV-UHFFFAOYSA-N |
Product Overview
5-(Aminomethylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione (CAS 90000-82-1), with molecular formula C7H9N3O3 and molecular weight 183.06 g/mol. IUPAC: 6-hydroxy-5-methanimidoyl-1,3-dimethylpyrimidine-2,4-dione.
Chemical Property Profile of 5-(Aminomethylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione
Property Insights of 5-(Aminomethylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione
The XLogP value of -1.0 indicates that 5-(Aminomethylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 84.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(Aminomethylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, 5-(Aminomethylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione has 2 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-(Aminomethylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione?
The CAS number of 5-(Aminomethylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione is 90000-82-1.
What is the molecular formula of 5-(Aminomethylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione?
The molecular formula of 5-(Aminomethylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione is C7H9N3O3.
What is the molecular weight of 5-(Aminomethylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione?
The molecular weight of 5-(Aminomethylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione is 183.06 g/mol.
Where can I buy 5-(Aminomethylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione?
You can request a quote for 5-(Aminomethylidene)-1,3-dimethyl-1,3-diazinane-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-(Aminomethylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for 5-(Aminomethylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.