2-Borono-N-(1-hydroxyethylidene)phenylalanine
TL;DR: 2-Borono-N-(1-hydroxyethylidene)phenylalanine (CAS 5115-46-8) is a chemical compound with molecular formula C11H14BNO5 and molecular weight 251.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-acetamido-3-(2-boronophenyl)propanoic acid
Also Known As: N-Acetyl-3-(o-boronophenyl)alanine, 2-Acetylamino-3- propionicacid, 2-acetamido-3-(2-boronophenyl)propanoic acid, ALANINE, N-ACETYL-3-(o-BORONOPHENYL)-, 2-Borono-N-(1-hydroxyethylidene)phenylalanine
| Molecular Formula | C11H14BNO5 |
|---|---|
| Molecular Weight | 251.10 g/mol |
| LogP | -1.5 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 251.0965 |
| Heavy Atoms | 18 |
| Complexity | 310.0 |
Chemical Identifiers
| CAS Number | 5115-46-8 |
|---|---|
| SMILES | B(C1=CC=CC=C1CC(C(=O)O)NC(=O)C)(O)O |
| InChIKey | NQAHBDDIAHDMMA-UHFFFAOYSA-N |
Product Overview
2-Borono-N-(1-hydroxyethylidene)phenylalanine (CAS 5115-46-8), with molecular formula C11H14BNO5 and molecular weight 251.10 g/mol. IUPAC: 2-acetamido-3-(2-boronophenyl)propanoic acid.
Chemical Property Profile of 2-Borono-N-(1-hydroxyethylidene)phenylalanine
Property Insights of 2-Borono-N-(1-hydroxyethylidene)phenylalanine
The XLogP value of -1.5 indicates that 2-Borono-N-(1-hydroxyethylidene)phenylalanine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Borono-N-(1-hydroxyethylidene)phenylalanine. Following Lipinski's Rule of Five, 2-Borono-N-(1-hydroxyethylidene)phenylalanine 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 2-Borono-N-(1-hydroxyethylidene)phenylalanine?
The CAS number of 2-Borono-N-(1-hydroxyethylidene)phenylalanine is 5115-46-8.
What is the molecular formula of 2-Borono-N-(1-hydroxyethylidene)phenylalanine?
The molecular formula of 2-Borono-N-(1-hydroxyethylidene)phenylalanine is C11H14BNO5.
What is the molecular weight of 2-Borono-N-(1-hydroxyethylidene)phenylalanine?
The molecular weight of 2-Borono-N-(1-hydroxyethylidene)phenylalanine is 251.10 g/mol.
Where can I buy 2-Borono-N-(1-hydroxyethylidene)phenylalanine?
You can request a quote for 2-Borono-N-(1-hydroxyethylidene)phenylalanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Borono-N-(1-hydroxyethylidene)phenylalanine?
Yes, KEHONG BIO provides custom synthesis services for 2-Borono-N-(1-hydroxyethylidene)phenylalanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.