3-((3,5-Dichlorobenzoyl)amino)-3-methyl-2-oxobutanoic acid
TL;DR: 3-((3,5-Dichlorobenzoyl)amino)-3-methyl-2-oxobutanoic acid (CAS 35923-97-8) is a chemical compound with molecular formula C12H11Cl2NO4 and molecular weight 303.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(3,5-dichlorobenzoyl)amino]-3-methyl-2-oxobutanoic acid
Also Known As: 3-((3,5-Dichlorobenzoyl)amino)-3-methyl-2-oxobutanoic acid, J1.661.863B, 3-[(3,5-dichlorobenzoyl)amino]-3-methyl-2-oxobutanoic acid, 3-(3,5-Dichlorobenzamido)-3-methyl-2-oxobutanoic acid, 3-(3,5-Dichlorobenzoylamino)-3-methyl-2-oxobutanoic acid
| Molecular Formula | C12H11Cl2NO4 |
|---|---|
| Molecular Weight | 303.01 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 83.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 303.0065 |
| Heavy Atoms | 19 |
| Complexity | 387.0 |
Chemical Identifiers
| CAS Number | 35923-97-8 |
|---|---|
| SMILES | CC(C)(C(=O)C(=O)O)NC(=O)C1=CC(=CC(=C1)Cl)Cl |
| InChIKey | IZNSVSSZBXFRBA-UHFFFAOYSA-N |
Product Overview
3-((3,5-Dichlorobenzoyl)amino)-3-methyl-2-oxobutanoic acid (CAS 35923-97-8), with molecular formula C12H11Cl2NO4 and molecular weight 303.01 g/mol. IUPAC: 3-[(3,5-dichlorobenzoyl)amino]-3-methyl-2-oxobutanoic acid.
Chemical Property Profile of 3-((3,5-Dichlorobenzoyl)amino)-3-methyl-2-oxobutanoic acid
Property Insights of 3-((3,5-Dichlorobenzoyl)amino)-3-methyl-2-oxobutanoic acid
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-((3,5-Dichlorobenzoyl)amino)-3-methyl-2-oxobutanoic acid. The TPSA of 83.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((3,5-Dichlorobenzoyl)amino)-3-methyl-2-oxobutanoic acid. Following Lipinski's Rule of Five, 3-((3,5-Dichlorobenzoyl)amino)-3-methyl-2-oxobutanoic acid has 2 hydrogen bond donor(s) and 4 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 3-((3,5-Dichlorobenzoyl)amino)-3-methyl-2-oxobutanoic acid?
The CAS number of 3-((3,5-Dichlorobenzoyl)amino)-3-methyl-2-oxobutanoic acid is 35923-97-8.
What is the molecular formula of 3-((3,5-Dichlorobenzoyl)amino)-3-methyl-2-oxobutanoic acid?
The molecular formula of 3-((3,5-Dichlorobenzoyl)amino)-3-methyl-2-oxobutanoic acid is C12H11Cl2NO4.
What is the molecular weight of 3-((3,5-Dichlorobenzoyl)amino)-3-methyl-2-oxobutanoic acid?
The molecular weight of 3-((3,5-Dichlorobenzoyl)amino)-3-methyl-2-oxobutanoic acid is 303.01 g/mol.
Where can I buy 3-((3,5-Dichlorobenzoyl)amino)-3-methyl-2-oxobutanoic acid?
You can request a quote for 3-((3,5-Dichlorobenzoyl)amino)-3-methyl-2-oxobutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((3,5-Dichlorobenzoyl)amino)-3-methyl-2-oxobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-((3,5-Dichlorobenzoyl)amino)-3-methyl-2-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.