N-(2-Methyl-1-oxobutyl)glycine methyl ester
TL;DR: N-(2-Methyl-1-oxobutyl)glycine methyl ester (CAS 52320-68-0) 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.
methyl 2-(2-methylbutanoylamino)acetate
Also Known As: .alpha.-Methylbutyrylglycine, methyl ester, Methyl N-(2-methylbutanoyl)glycinate, methyl 2-(2-methylbutanoylamino)acetate, N-(2-Methyl-1-oxobutyl)glycine methyl ester, METHYL 2-(2-METHYLBUTANAMIDO)ACETATE
| Molecular Formula | C8H15NO3 |
|---|---|
| Molecular Weight | 173.11 g/mol |
| LogP | 0.3217 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 173.1052 |
| Heavy Atoms | 12 |
| Complexity | 167.68591 |
Chemical Identifiers
| CAS Number | 52320-68-0 |
|---|---|
| SMILES | CCC(C)C(=O)NCC(=O)OC |
Product Overview
N-(2-Methyl-1-oxobutyl)glycine methyl ester (CAS 52320-68-0), with molecular formula C8H15NO3 and molecular weight 173.11 g/mol. IUPAC: methyl 2-(2-methylbutanoylamino)acetate.
Chemical Property Profile of N-(2-Methyl-1-oxobutyl)glycine methyl ester
Property Insights of N-(2-Methyl-1-oxobutyl)glycine methyl ester
The XLogP value of 0.3217 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-Methyl-1-oxobutyl)glycine methyl ester. With a topological polar surface area (TPSA) of 55.4 Ų, N-(2-Methyl-1-oxobutyl)glycine methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-Methyl-1-oxobutyl)glycine methyl ester has 1 hydrogen bond donor(s) and 3 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-(2-Methyl-1-oxobutyl)glycine methyl ester?
The CAS number of N-(2-Methyl-1-oxobutyl)glycine methyl ester is 52320-68-0.
What is the molecular formula of N-(2-Methyl-1-oxobutyl)glycine methyl ester?
The molecular formula of N-(2-Methyl-1-oxobutyl)glycine methyl ester is C8H15NO3.
What is the molecular weight of N-(2-Methyl-1-oxobutyl)glycine methyl ester?
The molecular weight of N-(2-Methyl-1-oxobutyl)glycine methyl ester is 173.11 g/mol.
Where can I buy N-(2-Methyl-1-oxobutyl)glycine methyl ester?
You can request a quote for N-(2-Methyl-1-oxobutyl)glycine methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-Methyl-1-oxobutyl)glycine methyl ester?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Methyl-1-oxobutyl)glycine methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.