2,3-Bis(benzoyloxy)-3-(dimethylcarbamoyl)propanoic acid
TL;DR: 2,3-Bis(benzoyloxy)-3-(dimethylcarbamoyl)propanoic acid (CAS 36624-61-0) is a chemical compound with molecular formula C20H19NO7 and molecular weight 385.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dibenzoyloxy-4-(dimethylamino)-4-oxobutanoic acid
Also Known As: 2,3-BIS(BENZOYLOXY)-3-(DIMETHYLCARBAMOYL)PROPANOIC ACID, 2,3-bis(benzoyloxy)-4-(dimethylamino)-4-oxobutanoic acid, 2,3-dibenzoyloxy-4-(dimethylamino)-4-oxobutanoic acid, (-)-O,O'-Dibenzoyl-L-tartaric acid mono(dimethylamide), (2R,3R)-2,3-Bis(benzoyloxy)-4-(dimethylamino)-4-oxobutanoic acid
| Molecular Formula | C20H19NO7 |
|---|---|
| Molecular Weight | 385.12 g/mol |
| LogP | 1.6104 |
| Topological Polar Surface Area | 110.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 385.11615 |
| Heavy Atoms | 28 |
| Complexity | 849.3726 |
Chemical Identifiers
| CAS Number | 36624-61-0 |
|---|---|
| SMILES | CN(C)C(=O)C(C(C(=O)O)OC(=O)C1=CC=CC=C1)OC(=O)C2=CC=CC=C2 |
Product Overview
2,3-Bis(benzoyloxy)-3-(dimethylcarbamoyl)propanoic acid (CAS 36624-61-0), with molecular formula C20H19NO7 and molecular weight 385.12 g/mol. IUPAC: 2,3-dibenzoyloxy-4-(dimethylamino)-4-oxobutanoic acid.
Chemical Property Profile of 2,3-Bis(benzoyloxy)-3-(dimethylcarbamoyl)propanoic acid
Property Insights of 2,3-Bis(benzoyloxy)-3-(dimethylcarbamoyl)propanoic acid
The XLogP value of 1.6104 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Bis(benzoyloxy)-3-(dimethylcarbamoyl)propanoic acid. The TPSA of 110.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3-Bis(benzoyloxy)-3-(dimethylcarbamoyl)propanoic acid. Following Lipinski's Rule of Five, 2,3-Bis(benzoyloxy)-3-(dimethylcarbamoyl)propanoic acid has 1 hydrogen bond donor(s) and 6 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 2,3-Bis(benzoyloxy)-3-(dimethylcarbamoyl)propanoic acid?
The CAS number of 2,3-Bis(benzoyloxy)-3-(dimethylcarbamoyl)propanoic acid is 36624-61-0.
What is the molecular formula of 2,3-Bis(benzoyloxy)-3-(dimethylcarbamoyl)propanoic acid?
The molecular formula of 2,3-Bis(benzoyloxy)-3-(dimethylcarbamoyl)propanoic acid is C20H19NO7.
What is the molecular weight of 2,3-Bis(benzoyloxy)-3-(dimethylcarbamoyl)propanoic acid?
The molecular weight of 2,3-Bis(benzoyloxy)-3-(dimethylcarbamoyl)propanoic acid is 385.12 g/mol.
Where can I buy 2,3-Bis(benzoyloxy)-3-(dimethylcarbamoyl)propanoic acid?
You can request a quote for 2,3-Bis(benzoyloxy)-3-(dimethylcarbamoyl)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Bis(benzoyloxy)-3-(dimethylcarbamoyl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Bis(benzoyloxy)-3-(dimethylcarbamoyl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.