(2S)-5-amino-2-(3,4-dihydroxyanilino)-5-oxopentanoic acid
TL;DR: (2S)-5-amino-2-(3,4-dihydroxyanilino)-5-oxopentanoic acid (CAS 58298-77-4) is a chemical compound with molecular formula C11H14N2O5 and molecular weight 254.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-5-amino-2-(3,4-dihydroxyanilino)-5-oxopentanoic acid
Also Known As: Agaridoxin, GDHB, (3,4-dihydroxyphenyl)-L-glutamine, gamma-L-Glutaminyl-3,4-dihydroxybenzene, 3,4-Dihydroxy-(gamma-1-glutamyl)anilide
| Molecular Formula | C11H14N2O5 |
|---|---|
| Molecular Weight | 254.09 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 133.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 254.09027 |
| Heavy Atoms | 18 |
| Complexity | 310.0 |
Chemical Identifiers
| CAS Number | 58298-77-4 |
|---|---|
| SMILES | C1=CC(=C(C=C1N[C@@H](CCC(=O)N)C(=O)O)O)O |
| InChIKey | SGMDQKBASJSDDV-ZETCQYMHSA-N |
Product Overview
(2S)-5-amino-2-(3,4-dihydroxyanilino)-5-oxopentanoic acid (CAS 58298-77-4), with molecular formula C11H14N2O5 and molecular weight 254.09 g/mol. IUPAC: (2S)-5-amino-2-(3,4-dihydroxyanilino)-5-oxopentanoic acid.
Chemical Property Profile of (2S)-5-amino-2-(3,4-dihydroxyanilino)-5-oxopentanoic acid
Property Insights of (2S)-5-amino-2-(3,4-dihydroxyanilino)-5-oxopentanoic acid
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-5-amino-2-(3,4-dihydroxyanilino)-5-oxopentanoic acid. The TPSA of 133.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-5-amino-2-(3,4-dihydroxyanilino)-5-oxopentanoic acid. Following Lipinski's Rule of Five, (2S)-5-amino-2-(3,4-dihydroxyanilino)-5-oxopentanoic acid has 5 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 (2S)-5-amino-2-(3,4-dihydroxyanilino)-5-oxopentanoic acid?
The CAS number of (2S)-5-amino-2-(3,4-dihydroxyanilino)-5-oxopentanoic acid is 58298-77-4.
What is the molecular formula of (2S)-5-amino-2-(3,4-dihydroxyanilino)-5-oxopentanoic acid?
The molecular formula of (2S)-5-amino-2-(3,4-dihydroxyanilino)-5-oxopentanoic acid is C11H14N2O5.
What is the molecular weight of (2S)-5-amino-2-(3,4-dihydroxyanilino)-5-oxopentanoic acid?
The molecular weight of (2S)-5-amino-2-(3,4-dihydroxyanilino)-5-oxopentanoic acid is 254.09 g/mol.
Where can I buy (2S)-5-amino-2-(3,4-dihydroxyanilino)-5-oxopentanoic acid?
You can request a quote for (2S)-5-amino-2-(3,4-dihydroxyanilino)-5-oxopentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-5-amino-2-(3,4-dihydroxyanilino)-5-oxopentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2S)-5-amino-2-(3,4-dihydroxyanilino)-5-oxopentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.