5-(Acetoacetylamino)benzimidazolone
TL;DR: 5-(Acetoacetylamino)benzimidazolone (CAS 26576-46-5) is a chemical compound with molecular formula C11H11N3O3 and molecular weight 233.08005 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)butanamide
Also Known As: 5-Acetoacetlamino benzimdazolone, 5-(Acetoacetamido)-2-benzimidazolinone, 5-Acetoacetaminobenzimidazolone, 5-(acetoacetylamino)benzimidazolone, Butanamide, N-(2,3-dihydro-2-oxo-1H-benzimidazol-5-yl)-3-oxo-
Application Areas
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H11N3O3 |
| Molecular Weight | 233.08005 g/mol |
| XLogP | 0.1 |
| Topological Polar Surface Area (TPSA) | 87.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.08005 Da |
| Heavy Atoms | 17 |
| Complexity | 356.0 |
| SMILES | CC(=O)CC(=O)NC1=CC2=C(C=C1)NC(=O)N2 |
| InChIKey | VEMDQCGHZNXORX-UHFFFAOYSA-N |
Chemical Property Profile of 5-(Acetoacetylamino)benzimidazolone
Property Insights of 5-(Acetoacetylamino)benzimidazolone
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Acetoacetylamino)benzimidazolone. The TPSA of 87.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(Acetoacetylamino)benzimidazolone. Following Lipinski's Rule of Five, 5-(Acetoacetylamino)benzimidazolone has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-(Acetoacetylamino)benzimidazolone?
The CAS number of 5-(Acetoacetylamino)benzimidazolone is 26576-46-5.
What is the molecular formula of 5-(Acetoacetylamino)benzimidazolone?
The molecular formula of 5-(Acetoacetylamino)benzimidazolone is C11H11N3O3.
What is the molecular weight of 5-(Acetoacetylamino)benzimidazolone?
The molecular weight of 5-(Acetoacetylamino)benzimidazolone is 233.08005 g/mol.
Where can I buy 5-(Acetoacetylamino)benzimidazolone?
You can request a quote for 5-(Acetoacetylamino)benzimidazolone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-(Acetoacetylamino)benzimidazolone?
Yes, CoreyChem provides custom synthesis services for 5-(Acetoacetylamino)benzimidazolone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.