2-acetamido-2-[(5-fluoro-1H-indol-3-yl)methyl]propanedioic acid
TL;DR: 2-acetamido-2-[(5-fluoro-1H-indol-3-yl)methyl]propanedioic acid (CAS 363-37-1) is a chemical compound with molecular formula C14H13FN2O5 and molecular weight 308.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-acetamido-2-[(5-fluoro-1H-indol-3-yl)methyl]propanedioic acid
Also Known As: 2-acetamido-2-[(5-fluoro-1H-indol-3-yl)methyl]propanedioic acid, Acetamido[(5-fluoro-1H-indol-3-yl)methyl]propanedioic acid, 2-acetamido-2-[(5-fluoro-1H-indol-3-yl)methyl]propanedioic a
| Molecular Formula | C14H13FN2O5 |
|---|---|
| Molecular Weight | 308.08 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 308.08084 |
| Heavy Atoms | 22 |
| Complexity | 470.0 |
Chemical Identifiers
| CAS Number | 363-37-1 |
|---|---|
| SMILES | CC(=O)NC(CC1=CNC2=C1C=C(C=C2)F)(C(=O)O)C(=O)O |
| InChIKey | DVEDTOQBOJHUHB-UHFFFAOYSA-N |
Product Overview
2-acetamido-2-[(5-fluoro-1H-indol-3-yl)methyl]propanedioic acid (CAS 363-37-1), with molecular formula C14H13FN2O5 and molecular weight 308.08 g/mol. IUPAC: 2-acetamido-2-[(5-fluoro-1H-indol-3-yl)methyl]propanedioic acid.
Chemical Property Profile of 2-acetamido-2-[(5-fluoro-1H-indol-3-yl)methyl]propanedioic acid
Property Insights of 2-acetamido-2-[(5-fluoro-1H-indol-3-yl)methyl]propanedioic acid
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-acetamido-2-[(5-fluoro-1H-indol-3-yl)methyl]propanedioic acid. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-acetamido-2-[(5-fluoro-1H-indol-3-yl)methyl]propanedioic acid. Following Lipinski's Rule of Five, 2-acetamido-2-[(5-fluoro-1H-indol-3-yl)methyl]propanedioic acid has 4 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 2-acetamido-2-[(5-fluoro-1H-indol-3-yl)methyl]propanedioic acid?
The CAS number of 2-acetamido-2-[(5-fluoro-1H-indol-3-yl)methyl]propanedioic acid is 363-37-1.
What is the molecular formula of 2-acetamido-2-[(5-fluoro-1H-indol-3-yl)methyl]propanedioic acid?
The molecular formula of 2-acetamido-2-[(5-fluoro-1H-indol-3-yl)methyl]propanedioic acid is C14H13FN2O5.
What is the molecular weight of 2-acetamido-2-[(5-fluoro-1H-indol-3-yl)methyl]propanedioic acid?
The molecular weight of 2-acetamido-2-[(5-fluoro-1H-indol-3-yl)methyl]propanedioic acid is 308.08 g/mol.
Where can I buy 2-acetamido-2-[(5-fluoro-1H-indol-3-yl)methyl]propanedioic acid?
You can request a quote for 2-acetamido-2-[(5-fluoro-1H-indol-3-yl)methyl]propanedioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-acetamido-2-[(5-fluoro-1H-indol-3-yl)methyl]propanedioic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-acetamido-2-[(5-fluoro-1H-indol-3-yl)methyl]propanedioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.