Ethyl 2-(2-(tert-butoxycarbonylamino)-3-phenylpropanamido)acetate
TL;DR: Ethyl 2-(2-(tert-butoxycarbonylamino)-3-phenylpropanamido)acetate (CAS 125719-13-3) is a chemical compound with molecular formula C18H26N2O5 and molecular weight 350.18417 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]amino]acetate
Also Known As: Ethyl 2-[2-(Boc-amino)-3-phenylpropanamido]acetate, Ethyl (tert-butoxycarbonyl)phenylalanylglycinate, Ethyl 2-(2-(tert-butoxycarbonylamino)-3-phenylpropanamido)acetate, ethyl 2-(2-{[(tert-butoxy)carbonyl]amino}-3-phenylpropanamido)acetate, Ethyl 2-(2-((tert-butoxycarbonyl)amino)-3-phenylpropanamido)acetate
Technical Specifications
| Molecular Formula | C18H26N2O5 |
| Molecular Weight | 350.18417 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 93.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 350.18417 Da |
| Heavy Atoms | 25 |
| Complexity | 453.0 |
| SMILES | CCOC(=O)CNC(=O)C(CC1=CC=CC=C1)NC(=O)OC(C)(C)C |
| InChIKey | RGIBNLUTUQVQMZ-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 2-(2-(tert-butoxycarbonylamino)-3-phenylpropanamido)acetate
Property Insights of Ethyl 2-(2-(tert-butoxycarbonylamino)-3-phenylpropanamido)acetate
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-(2-(tert-butoxycarbonylamino)-3-phenylpropanamido)acetate. The TPSA of 93.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-(2-(tert-butoxycarbonylamino)-3-phenylpropanamido)acetate. Following Lipinski's Rule of Five, Ethyl 2-(2-(tert-butoxycarbonylamino)-3-phenylpropanamido)acetate has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ethyl 2-(2-(tert-butoxycarbonylamino)-3-phenylpropanamido)acetate?
The CAS number of Ethyl 2-(2-(tert-butoxycarbonylamino)-3-phenylpropanamido)acetate is 125719-13-3.
What is the molecular formula of Ethyl 2-(2-(tert-butoxycarbonylamino)-3-phenylpropanamido)acetate?
The molecular formula of Ethyl 2-(2-(tert-butoxycarbonylamino)-3-phenylpropanamido)acetate is C18H26N2O5.
What is the molecular weight of Ethyl 2-(2-(tert-butoxycarbonylamino)-3-phenylpropanamido)acetate?
The molecular weight of Ethyl 2-(2-(tert-butoxycarbonylamino)-3-phenylpropanamido)acetate is 350.18417 g/mol.
Where can I buy Ethyl 2-(2-(tert-butoxycarbonylamino)-3-phenylpropanamido)acetate?
You can request a quote for Ethyl 2-(2-(tert-butoxycarbonylamino)-3-phenylpropanamido)acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 2-(2-(tert-butoxycarbonylamino)-3-phenylpropanamido)acetate?
Yes, CoreyChem provides custom synthesis services for Ethyl 2-(2-(tert-butoxycarbonylamino)-3-phenylpropanamido)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.