N-butanoylglycine ethyl ester
TL;DR: N-butanoylglycine ethyl ester (CAS 90205-46-2) 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.
ethyl 2-(butanoylamino)acetate
Also Known As: N-butanoylglycine ethyl ester, Ethyl 2-(butanoylamino)acetate, Ethyl N-butanoylglycinate, Ethyl 2-butyramidoacetate, Glycine,N- -,ethylester
| Molecular Formula | C8H15NO3 |
|---|---|
| Molecular Weight | 173.11 g/mol |
| LogP | 0.4658 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 173.1052 |
| Heavy Atoms | 12 |
| Complexity | 138.38196 |
Chemical Identifiers
| CAS Number | 90205-46-2 |
|---|---|
| SMILES | CCCC(=O)NCC(=O)OCC |
Product Overview
N-butanoylglycine ethyl ester (CAS 90205-46-2), with molecular formula C8H15NO3 and molecular weight 173.11 g/mol. IUPAC: ethyl 2-(butanoylamino)acetate.
Chemical Property Profile of N-butanoylglycine ethyl ester
Property Insights of N-butanoylglycine ethyl ester
The XLogP value of 0.4658 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-butanoylglycine ethyl ester. With a topological polar surface area (TPSA) of 55.4 Ų, N-butanoylglycine ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-butanoylglycine ethyl 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-butanoylglycine ethyl ester?
The CAS number of N-butanoylglycine ethyl ester is 90205-46-2.
What is the molecular formula of N-butanoylglycine ethyl ester?
The molecular formula of N-butanoylglycine ethyl ester is C8H15NO3.
What is the molecular weight of N-butanoylglycine ethyl ester?
The molecular weight of N-butanoylglycine ethyl ester is 173.11 g/mol.
Where can I buy N-butanoylglycine ethyl ester?
You can request a quote for N-butanoylglycine ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-butanoylglycine ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for N-butanoylglycine ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.