Butanamide, N-(4-chloro-2-methylphenyl)-3-oxo-
TL;DR: Butanamide, N-(4-chloro-2-methylphenyl)-3-oxo- (CAS 20139-55-3) is a chemical compound with molecular formula C11H12ClNO2 and molecular weight 225.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chloro-2-methylphenyl)-3-oxobutanamide
Also Known As: 4'-Chloro-2'-methylacetoacetanilide, n-(4-chloro-2-methylphenyl)-3-oxobutanamide, Azapropazone, o-Acetoacetotoluidide, 4'-chloro-, Butanamide, N-(4-chloro-2-methylphenyl)-3-oxo-
| Molecular Formula | C11H12ClNO2 |
|---|---|
| Molecular Weight | 225.06 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 225.05565 |
| Heavy Atoms | 15 |
| Complexity | 255.0 |
Chemical Identifiers
| CAS Number | 20139-55-3 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)Cl)NC(=O)CC(=O)C |
| InChIKey | ODFRAIZRJMUPCP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butanamide, N-(4-chloro-2-methylphenyl)-3-oxo- (CAS 20139-55-3), with molecular formula C11H12ClNO2 and molecular weight 225.06 g/mol. IUPAC: N-(4-chloro-2-methylphenyl)-3-oxobutanamide.
Chemical Property Profile of Butanamide, N-(4-chloro-2-methylphenyl)-3-oxo-
Property Insights of Butanamide, N-(4-chloro-2-methylphenyl)-3-oxo-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butanamide, N-(4-chloro-2-methylphenyl)-3-oxo-. With a topological polar surface area (TPSA) of 46.2 Ų, Butanamide, N-(4-chloro-2-methylphenyl)-3-oxo- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butanamide, N-(4-chloro-2-methylphenyl)-3-oxo- has 1 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 Butanamide, N-(4-chloro-2-methylphenyl)-3-oxo-?
The CAS number of Butanamide, N-(4-chloro-2-methylphenyl)-3-oxo- is 20139-55-3.
What is the molecular formula of Butanamide, N-(4-chloro-2-methylphenyl)-3-oxo-?
The molecular formula of Butanamide, N-(4-chloro-2-methylphenyl)-3-oxo- is C11H12ClNO2.
What is the molecular weight of Butanamide, N-(4-chloro-2-methylphenyl)-3-oxo-?
The molecular weight of Butanamide, N-(4-chloro-2-methylphenyl)-3-oxo- is 225.06 g/mol.
Where can I buy Butanamide, N-(4-chloro-2-methylphenyl)-3-oxo-?
You can request a quote for Butanamide, N-(4-chloro-2-methylphenyl)-3-oxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butanamide, N-(4-chloro-2-methylphenyl)-3-oxo-?
Yes, KEHONG BIO provides custom synthesis services for Butanamide, N-(4-chloro-2-methylphenyl)-3-oxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.