1,3-Diacetyl-2-imidazolidinone
TL;DR: 1,3-Diacetyl-2-imidazolidinone (CAS 5406-22-4) 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.
1,3-diacetylimidazolidin-2-one
Also Known As: 1,3-Diacetyl-2-imidazolidinone, 1,3-diacetylimidazolidin-2-one, 2-Imidazolidinone, 1,3-diacetyl-, Tizanidine Impurity 40, 1,1'-(2-Oxoimidazolidine-1,3-diyl)diethanone
| Molecular Formula | C7H10N2O3 |
|---|---|
| Molecular Weight | 170.07 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 57.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 170.06914 |
| Heavy Atoms | 12 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 5406-22-4 |
|---|---|
| SMILES | CC(=O)N1CCN(C1=O)C(=O)C |
| InChIKey | PAFPWEIHSLHEJT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Diacetyl-2-imidazolidinone (CAS 5406-22-4), with molecular formula C7H10N2O3 and molecular weight 170.07 g/mol. IUPAC: 1,3-diacetylimidazolidin-2-one.
Chemical Property Profile of 1,3-Diacetyl-2-imidazolidinone
Property Insights of 1,3-Diacetyl-2-imidazolidinone
The XLogP value of -0.9 indicates that 1,3-Diacetyl-2-imidazolidinone is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 57.7 Ų, 1,3-Diacetyl-2-imidazolidinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Diacetyl-2-imidazolidinone has 0 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 1,3-Diacetyl-2-imidazolidinone?
The CAS number of 1,3-Diacetyl-2-imidazolidinone is 5406-22-4.
What is the molecular formula of 1,3-Diacetyl-2-imidazolidinone?
The molecular formula of 1,3-Diacetyl-2-imidazolidinone is C7H10N2O3.
What is the molecular weight of 1,3-Diacetyl-2-imidazolidinone?
The molecular weight of 1,3-Diacetyl-2-imidazolidinone is 170.07 g/mol.
Where can I buy 1,3-Diacetyl-2-imidazolidinone?
You can request a quote for 1,3-Diacetyl-2-imidazolidinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Diacetyl-2-imidazolidinone?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Diacetyl-2-imidazolidinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.