4-Amino-2,3-bis(benzoyloxy)-4-oxobutanoic acid
TL;DR: 4-Amino-2,3-bis(benzoyloxy)-4-oxobutanoic acid (CAS 98341-66-3) is a chemical compound with molecular formula C18H15NO7 and molecular weight 357.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-2,3-dibenzoyloxy-4-oxobutanoic acid
Also Known As: 4-amino-2,3-bis(benzoyloxy)-4-oxobutanoic acid, 4-amino-2,3-dibenzoyloxy-4-oxobutanoic acid, 4-amino-2,3-bis(benzoyloxy)-4-oxobutanoicacid, 4-amino-2,3-dibenzoyloxy-4-oxo-butanoic acid, 2,3-BIS(BENZOYLOXY)-3-CARBAMOYLPROPANOIC ACID
| Molecular Formula | C18H15NO7 |
|---|---|
| Molecular Weight | 357.08 g/mol |
| LogP | 1.0075 |
| Topological Polar Surface Area | 132.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 357.08484 |
| Heavy Atoms | 26 |
| Complexity | 735.304 |
Chemical Identifiers
| CAS Number | 98341-66-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)OC(C(C(=O)O)OC(=O)C2=CC=CC=C2)C(=O)N |
Product Overview
4-Amino-2,3-bis(benzoyloxy)-4-oxobutanoic acid (CAS 98341-66-3), with molecular formula C18H15NO7 and molecular weight 357.08 g/mol. IUPAC: 4-amino-2,3-dibenzoyloxy-4-oxobutanoic acid.
Chemical Property Profile of 4-Amino-2,3-bis(benzoyloxy)-4-oxobutanoic acid
Property Insights of 4-Amino-2,3-bis(benzoyloxy)-4-oxobutanoic acid
The XLogP value of 1.0075 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Amino-2,3-bis(benzoyloxy)-4-oxobutanoic acid. The TPSA of 132.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-2,3-bis(benzoyloxy)-4-oxobutanoic acid. Following Lipinski's Rule of Five, 4-Amino-2,3-bis(benzoyloxy)-4-oxobutanoic acid has 2 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 4-Amino-2,3-bis(benzoyloxy)-4-oxobutanoic acid?
The CAS number of 4-Amino-2,3-bis(benzoyloxy)-4-oxobutanoic acid is 98341-66-3.
What is the molecular formula of 4-Amino-2,3-bis(benzoyloxy)-4-oxobutanoic acid?
The molecular formula of 4-Amino-2,3-bis(benzoyloxy)-4-oxobutanoic acid is C18H15NO7.
What is the molecular weight of 4-Amino-2,3-bis(benzoyloxy)-4-oxobutanoic acid?
The molecular weight of 4-Amino-2,3-bis(benzoyloxy)-4-oxobutanoic acid is 357.08 g/mol.
Where can I buy 4-Amino-2,3-bis(benzoyloxy)-4-oxobutanoic acid?
You can request a quote for 4-Amino-2,3-bis(benzoyloxy)-4-oxobutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Amino-2,3-bis(benzoyloxy)-4-oxobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-2,3-bis(benzoyloxy)-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.