(2S)-2-amino-3-[2-(hydroxycarbamoyl)-1H-indol-3-yl]propanoic acid
TL;DR: (2S)-2-amino-3-[2-(hydroxycarbamoyl)-1H-indol-3-yl]propanoic acid (CAS 5814-96-0) is a chemical compound with molecular formula C12H13N3O4 and molecular weight 263.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-amino-3-[2-(hydroxycarbamoyl)-1H-indol-3-yl]propanoic acid
Also Known As: Tryptophanhydroxamate, (2S)-2-amino-3-[2-(hydroxycarbamoyl)-1H-indol-3-yl]propanoic acid
| Molecular Formula | C12H13N3O4 |
|---|---|
| Molecular Weight | 263.09 g/mol |
| LogP | -2.2 |
| Topological Polar Surface Area | 128.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 263.0906 |
| Heavy Atoms | 19 |
| Complexity | 363.0 |
Chemical Identifiers
| CAS Number | 5814-96-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C(N2)C(=O)NO)C[C@@H](C(=O)O)N |
| InChIKey | MRXBXQRTYLOQDV-QMMMGPOBSA-N |
Product Overview
(2S)-2-amino-3-[2-(hydroxycarbamoyl)-1H-indol-3-yl]propanoic acid (CAS 5814-96-0), with molecular formula C12H13N3O4 and molecular weight 263.09 g/mol. IUPAC: (2S)-2-amino-3-[2-(hydroxycarbamoyl)-1H-indol-3-yl]propanoic acid.
Chemical Property Profile of (2S)-2-amino-3-[2-(hydroxycarbamoyl)-1H-indol-3-yl]propanoic acid
Property Insights of (2S)-2-amino-3-[2-(hydroxycarbamoyl)-1H-indol-3-yl]propanoic acid
The XLogP value of -2.2 indicates that (2S)-2-amino-3-[2-(hydroxycarbamoyl)-1H-indol-3-yl]propanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 128.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-2-amino-3-[2-(hydroxycarbamoyl)-1H-indol-3-yl]propanoic acid. Following Lipinski's Rule of Five, (2S)-2-amino-3-[2-(hydroxycarbamoyl)-1H-indol-3-yl]propanoic acid has 5 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)-2-amino-3-[2-(hydroxycarbamoyl)-1H-indol-3-yl]propanoic acid?
The CAS number of (2S)-2-amino-3-[2-(hydroxycarbamoyl)-1H-indol-3-yl]propanoic acid is 5814-96-0.
What is the molecular formula of (2S)-2-amino-3-[2-(hydroxycarbamoyl)-1H-indol-3-yl]propanoic acid?
The molecular formula of (2S)-2-amino-3-[2-(hydroxycarbamoyl)-1H-indol-3-yl]propanoic acid is C12H13N3O4.
What is the molecular weight of (2S)-2-amino-3-[2-(hydroxycarbamoyl)-1H-indol-3-yl]propanoic acid?
The molecular weight of (2S)-2-amino-3-[2-(hydroxycarbamoyl)-1H-indol-3-yl]propanoic acid is 263.09 g/mol.
Where can I buy (2S)-2-amino-3-[2-(hydroxycarbamoyl)-1H-indol-3-yl]propanoic acid?
You can request a quote for (2S)-2-amino-3-[2-(hydroxycarbamoyl)-1H-indol-3-yl]propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-2-amino-3-[2-(hydroxycarbamoyl)-1H-indol-3-yl]propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2S)-2-amino-3-[2-(hydroxycarbamoyl)-1H-indol-3-yl]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.