N-Acetylisoleucine
TL;DR: N-Acetylisoleucine (CAS 3077-46-1) is a chemical compound with molecular formula C8H15NO3 and molecular weight 173.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S)-2-acetamido-3-methylpentanoic acid
Also Known As: N-Acetyl-L-isoleucine, N-Acetylisoleucine, L-Isoleucine, N-acetyl-, (2S,3S)-2-acetamido-3-methylpentanoic acid, Acetyl-L-isoleucine
| Molecular Formula | C8H15NO3 |
|---|---|
| Molecular Weight | 173.11 g/mol |
| LogP | 0.6218 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 173.1052 |
| Heavy Atoms | 12 |
| Complexity | 179.14178 |
Chemical Identifiers
| CAS Number | 3077-46-1 |
|---|---|
| SMILES | CC[C@H](C)[C@@H](C(=O)O)NC(=O)C |
Product Overview
N-Acetylisoleucine (CAS 3077-46-1), with molecular formula C8H15NO3 and molecular weight 173.11 g/mol. IUPAC: (2S,3S)-2-acetamido-3-methylpentanoic acid.
Chemical Property Profile of N-Acetylisoleucine
Property Insights of N-Acetylisoleucine
The XLogP value of 0.6218 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Acetylisoleucine. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Acetylisoleucine. Following Lipinski's Rule of Five, N-Acetylisoleucine has 2 hydrogen bond donor(s) and 2 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 N-Acetylisoleucine?
The CAS number of N-Acetylisoleucine is 3077-46-1.
What is the molecular formula of N-Acetylisoleucine?
The molecular formula of N-Acetylisoleucine is C8H15NO3.
What is the molecular weight of N-Acetylisoleucine?
The molecular weight of N-Acetylisoleucine is 173.11 g/mol.
Where can I buy N-Acetylisoleucine?
You can request a quote for N-Acetylisoleucine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Acetylisoleucine?
Yes, KEHONG BIO provides custom synthesis services for N-Acetylisoleucine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.