1,3-Diazepane-2,4-dione
TL;DR: 1,3-Diazepane-2,4-dione (CAS 75548-99-1) is a chemical compound with molecular formula C5H8N2O2 and molecular weight 128.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-diazepane-2,4-dione
Also Known As: 1,3-Diazepane-2,4-dione, [1,3]Diazepan-2,4-dione, 1,3-Diazepane-2,4-dione #, tetrahydro-2H-1,3-diazepine-2,4(3H)-dione, 1H-1,3-DIAZEPINE-2,4(3H,5H)-DIONE, DIHYDRO
| Molecular Formula | C5H8N2O2 |
|---|---|
| Molecular Weight | 128.06 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 128.05858 |
| Heavy Atoms | 9 |
| Complexity | 144.0 |
Chemical Identifiers
| CAS Number | 75548-99-1 |
|---|---|
| SMILES | C1CC(=O)NC(=O)NC1 |
| InChIKey | GOFALJDPGWIYKL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Diazepane-2,4-dione (CAS 75548-99-1), with molecular formula C5H8N2O2 and molecular weight 128.06 g/mol. IUPAC: 1,3-diazepane-2,4-dione.
Chemical Property Profile of 1,3-Diazepane-2,4-dione
Property Insights of 1,3-Diazepane-2,4-dione
The XLogP value of -0.8 indicates that 1,3-Diazepane-2,4-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 58.2 Ų, 1,3-Diazepane-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Diazepane-2,4-dione has 2 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 1,3-Diazepane-2,4-dione?
The CAS number of 1,3-Diazepane-2,4-dione is 75548-99-1.
What is the molecular formula of 1,3-Diazepane-2,4-dione?
The molecular formula of 1,3-Diazepane-2,4-dione is C5H8N2O2.
What is the molecular weight of 1,3-Diazepane-2,4-dione?
The molecular weight of 1,3-Diazepane-2,4-dione is 128.06 g/mol.
Where can I buy 1,3-Diazepane-2,4-dione?
You can request a quote for 1,3-Diazepane-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Diazepane-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Diazepane-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.