(2S,3S)-2,3-Dihydroxy-4-oxo-4-(phenylamino)butanoic acid
TL;DR: (2S,3S)-2,3-Dihydroxy-4-oxo-4-(phenylamino)butanoic acid (CAS 57426-78-5) is a chemical compound with molecular formula C10H11NO5 and molecular weight 225.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-anilino-2,3-dihydroxy-4-oxobutanoic acid
Also Known As: Weinsaeureanilid, (2R,3R)-Tartranilic Acid, (+)-tartranilic acid, (S,S)-Tartranilic acid, Tartaric acid monoamide, N-phenyl-
| Molecular Formula | C10H11NO5 |
|---|---|
| Molecular Weight | 225.06 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 225.06372 |
| Heavy Atoms | 16 |
| Complexity | 262.0 |
Chemical Identifiers
| CAS Number | 57426-78-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)C(C(C(=O)O)O)O |
| InChIKey | ZWXNRJCDXZFNLJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(2S,3S)-2,3-Dihydroxy-4-oxo-4-(phenylamino)butanoic acid (CAS 57426-78-5), with molecular formula C10H11NO5 and molecular weight 225.06 g/mol. IUPAC: 4-anilino-2,3-dihydroxy-4-oxobutanoic acid.
Chemical Property Profile of (2S,3S)-2,3-Dihydroxy-4-oxo-4-(phenylamino)butanoic acid
Property Insights of (2S,3S)-2,3-Dihydroxy-4-oxo-4-(phenylamino)butanoic acid
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S,3S)-2,3-Dihydroxy-4-oxo-4-(phenylamino)butanoic acid. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S,3S)-2,3-Dihydroxy-4-oxo-4-(phenylamino)butanoic acid. Following Lipinski's Rule of Five, (2S,3S)-2,3-Dihydroxy-4-oxo-4-(phenylamino)butanoic acid has 4 hydrogen bond donor(s) and 5 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 (2S,3S)-2,3-Dihydroxy-4-oxo-4-(phenylamino)butanoic acid?
The CAS number of (2S,3S)-2,3-Dihydroxy-4-oxo-4-(phenylamino)butanoic acid is 57426-78-5.
What is the molecular formula of (2S,3S)-2,3-Dihydroxy-4-oxo-4-(phenylamino)butanoic acid?
The molecular formula of (2S,3S)-2,3-Dihydroxy-4-oxo-4-(phenylamino)butanoic acid is C10H11NO5.
What is the molecular weight of (2S,3S)-2,3-Dihydroxy-4-oxo-4-(phenylamino)butanoic acid?
The molecular weight of (2S,3S)-2,3-Dihydroxy-4-oxo-4-(phenylamino)butanoic acid is 225.06 g/mol.
Where can I buy (2S,3S)-2,3-Dihydroxy-4-oxo-4-(phenylamino)butanoic acid?
You can request a quote for (2S,3S)-2,3-Dihydroxy-4-oxo-4-(phenylamino)butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S,3S)-2,3-Dihydroxy-4-oxo-4-(phenylamino)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2S,3S)-2,3-Dihydroxy-4-oxo-4-(phenylamino)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.