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Tert-butyl n-[(benzyloxy)carbonyl]alanylglycinate
TL;DR: Tert-butyl n-[(benzyloxy)carbonyl]alanylglycinate (CAS 13547-68-7) is a chemical compound with molecular formula C17H24N2O5 and molecular weight 336.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl 2-[2-(phenylmethoxycarbonylamino)propanoylamino]acetate
Also Known As: tert-butyl n-[(benzyloxy)carbonyl]alanylglycinate, tert-butyl 2-[2-(phenylmethoxycarbonylamino)propanoylamino]acetate
| Molecular Formula | C17H24N2O5 |
|---|---|
| Molecular Weight | 336.17 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 93.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 336.16852 |
| Heavy Atoms | 24 |
| Complexity | 439.0 |
Chemical Identifiers
| CAS Number | 13547-68-7 |
|---|---|
| SMILES | CC(C(=O)NCC(=O)OC(C)(C)C)NC(=O)OCC1=CC=CC=C1 |
| InChIKey | WJVKOPPVPCFLMG-UHFFFAOYSA-N |
Product Overview
Tert-butyl n-[(benzyloxy)carbonyl]alanylglycinate (CAS 13547-68-7), with molecular formula C17H24N2O5 and molecular weight 336.17 g/mol. IUPAC: tert-butyl 2-[2-(phenylmethoxycarbonylamino)propanoylamino]acetate.
Chemical Property Profile of Tert-butyl n-[(benzyloxy)carbonyl]alanylglycinate
Property Insights of Tert-butyl n-[(benzyloxy)carbonyl]alanylglycinate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tert-butyl n-[(benzyloxy)carbonyl]alanylglycinate. The TPSA of 93.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Tert-butyl n-[(benzyloxy)carbonyl]alanylglycinate. Following Lipinski's Rule of Five, Tert-butyl n-[(benzyloxy)carbonyl]alanylglycinate 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
Frequently Asked Questions
What is the CAS number of Tert-butyl n-[(benzyloxy)carbonyl]alanylglycinate?
The CAS number of Tert-butyl n-[(benzyloxy)carbonyl]alanylglycinate is 13547-68-7.
What is the molecular formula of Tert-butyl n-[(benzyloxy)carbonyl]alanylglycinate?
The molecular formula of Tert-butyl n-[(benzyloxy)carbonyl]alanylglycinate is C17H24N2O5.
What is the molecular weight of Tert-butyl n-[(benzyloxy)carbonyl]alanylglycinate?
The molecular weight of Tert-butyl n-[(benzyloxy)carbonyl]alanylglycinate is 336.17 g/mol.
Where can I buy Tert-butyl n-[(benzyloxy)carbonyl]alanylglycinate?
You can request a quote for Tert-butyl n-[(benzyloxy)carbonyl]alanylglycinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tert-butyl n-[(benzyloxy)carbonyl]alanylglycinate?
Yes, KEHONG BIO provides custom synthesis services for Tert-butyl n-[(benzyloxy)carbonyl]alanylglycinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.