(2S)-2-[(furan-2-yl)formamido]-3-methylbutanoic acid
TL;DR: (2S)-2-[(furan-2-yl)formamido]-3-methylbutanoic acid (CAS 462065-68-5) is a chemical compound with molecular formula C10H13NO4 and molecular weight 211.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-(furan-2-carbonylamino)-3-methylbutanoic acid
Also Known As: N-2-Furoylvaline, (2S)-2-(2-furoylamino)-3-methylbutanoic acid, (2S)-2-[(furan-2-yl)formamido]-3-methylbutanoic acid, (2S)-2-(furan-2-carbonylamino)-3-methylbutanoic acid, (2S)-2-(FURAN-2-YLFORMAMIDO)-3-METHYLBUTANOIC ACID
| Molecular Formula | C10H13NO4 |
|---|---|
| Molecular Weight | 211.08 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 79.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 211.08446 |
| Heavy Atoms | 15 |
| Complexity | 252.0 |
Chemical Identifiers
| CAS Number | 462065-68-5 |
|---|---|
| SMILES | CC(C)[C@@H](C(=O)O)NC(=O)C1=CC=CO1 |
| InChIKey | SGPKMOKGOBWXPC-QMMMGPOBSA-N |
Product Overview
(2S)-2-[(furan-2-yl)formamido]-3-methylbutanoic acid (CAS 462065-68-5), with molecular formula C10H13NO4 and molecular weight 211.08 g/mol. IUPAC: (2S)-2-(furan-2-carbonylamino)-3-methylbutanoic acid.
Chemical Property Profile of (2S)-2-[(furan-2-yl)formamido]-3-methylbutanoic acid
Property Insights of (2S)-2-[(furan-2-yl)formamido]-3-methylbutanoic acid
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-2-[(furan-2-yl)formamido]-3-methylbutanoic acid. The TPSA of 79.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-2-[(furan-2-yl)formamido]-3-methylbutanoic acid. Following Lipinski's Rule of Five, (2S)-2-[(furan-2-yl)formamido]-3-methylbutanoic acid has 2 hydrogen bond donor(s) and 4 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-[(furan-2-yl)formamido]-3-methylbutanoic acid?
The CAS number of (2S)-2-[(furan-2-yl)formamido]-3-methylbutanoic acid is 462065-68-5.
What is the molecular formula of (2S)-2-[(furan-2-yl)formamido]-3-methylbutanoic acid?
The molecular formula of (2S)-2-[(furan-2-yl)formamido]-3-methylbutanoic acid is C10H13NO4.
What is the molecular weight of (2S)-2-[(furan-2-yl)formamido]-3-methylbutanoic acid?
The molecular weight of (2S)-2-[(furan-2-yl)formamido]-3-methylbutanoic acid is 211.08 g/mol.
Where can I buy (2S)-2-[(furan-2-yl)formamido]-3-methylbutanoic acid?
You can request a quote for (2S)-2-[(furan-2-yl)formamido]-3-methylbutanoic 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-[(furan-2-yl)formamido]-3-methylbutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2S)-2-[(furan-2-yl)formamido]-3-methylbutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.