Diurea
TL;DR: Diurea (CAS 624-40-8) is a chemical compound with molecular formula C1(=O)NNC(=O)NN1 and molecular weight 116.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,4,5-tetrazinane-3,6-dione
Also Known As: p-Urazine, Diurea, Dicarbamide, 1,2,4,5-tetrazinane-3,6-dione, Tetrahydro-1,2,4,5-tetrazine-3,6-dione
| Molecular Formula | C1(=O)NNC(=O)NN1 |
|---|---|
| Molecular Weight | 116.03 g/mol |
| LogP | -1.3 |
| Topological Polar Surface Area | 82.3 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 116.033424 |
| Heavy Atoms | 8 |
| Complexity | 104.0 |
Chemical Identifiers
| CAS Number | 624-40-8 |
|---|---|
| SMILES | C1(=O)NNC(=O)NN1 |
| InChIKey | XMKLTEGSALONPH-UHFFFAOYSA-N |
Product Overview
Diurea (CAS 624-40-8), with molecular formula C1(=O)NNC(=O)NN1 and molecular weight 116.03 g/mol. IUPAC: 1,2,4,5-tetrazinane-3,6-dione.
Chemical Property Profile of Diurea
Property Insights of Diurea
The XLogP value of -1.3 indicates that Diurea is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 82.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Diurea. Following Lipinski's Rule of Five, Diurea has 4 hydrogen bond donor(s) and 2 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 Diurea?
The CAS number of Diurea is 624-40-8.
What is the molecular formula of Diurea?
The molecular formula of Diurea is C1(=O)NNC(=O)NN1.
What is the molecular weight of Diurea?
The molecular weight of Diurea is 116.03 g/mol.
Where can I buy Diurea?
You can request a quote for Diurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diurea?
Yes, KEHONG BIO provides custom synthesis services for Diurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.