5-Ethyl-1,3-diazepane-2,4,7-trione
TL;DR: 5-Ethyl-1,3-diazepane-2,4,7-trione (CAS 5426-41-5) is a chemical compound with molecular formula C7H10N2O3 and molecular weight 170.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethyl-1,3-diazepane-2,4,7-trione
Also Known As: i-Propoxy-cyclopropan, 5-ethyl-1,3-diazepane-2,4,7-trione, 1H-1,3-Diazepine-2,4,7(3H)-trione,5-ethyldihydro-
| Molecular Formula | C7H10N2O3 |
|---|---|
| Molecular Weight | 170.07 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 75.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 170.06914 |
| Heavy Atoms | 12 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 5426-41-5 |
|---|---|
| SMILES | CCC1CC(=O)NC(=O)NC1=O |
| InChIKey | QOVCFFVYNXAOGA-UHFFFAOYSA-N |
Product Overview
5-Ethyl-1,3-diazepane-2,4,7-trione (CAS 5426-41-5), with molecular formula C7H10N2O3 and molecular weight 170.07 g/mol. IUPAC: 5-ethyl-1,3-diazepane-2,4,7-trione.
Chemical Property Profile of 5-Ethyl-1,3-diazepane-2,4,7-trione
Property Insights of 5-Ethyl-1,3-diazepane-2,4,7-trione
The XLogP value of -0.5 indicates that 5-Ethyl-1,3-diazepane-2,4,7-trione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 75.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Ethyl-1,3-diazepane-2,4,7-trione. Following Lipinski's Rule of Five, 5-Ethyl-1,3-diazepane-2,4,7-trione has 2 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-Ethyl-1,3-diazepane-2,4,7-trione?
The CAS number of 5-Ethyl-1,3-diazepane-2,4,7-trione is 5426-41-5.
What is the molecular formula of 5-Ethyl-1,3-diazepane-2,4,7-trione?
The molecular formula of 5-Ethyl-1,3-diazepane-2,4,7-trione is C7H10N2O3.
What is the molecular weight of 5-Ethyl-1,3-diazepane-2,4,7-trione?
The molecular weight of 5-Ethyl-1,3-diazepane-2,4,7-trione is 170.07 g/mol.
Where can I buy 5-Ethyl-1,3-diazepane-2,4,7-trione?
You can request a quote for 5-Ethyl-1,3-diazepane-2,4,7-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Ethyl-1,3-diazepane-2,4,7-trione?
Yes, KEHONG BIO provides custom synthesis services for 5-Ethyl-1,3-diazepane-2,4,7-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.