2-carbethoxy-N-(benzyloxycarbonyl)glycine
TL;DR: 2-carbethoxy-N-(benzyloxycarbonyl)glycine (CAS 7682-49-7) is a chemical compound with molecular formula C13H15NO6 and molecular weight 281.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethoxy-3-oxo-2-(phenylmethoxycarbonylamino)propanoic acid
Also Known As: 2-carbethoxy-N-(benzyloxycarbonyl)glycine, NCI60_023948, N-[(Benzyloxy)carbonyl]-O-ethyl-3-oxoserine-, (Carbobenzoxyamino)malonic acid 1-ethyl ester, 2-(benzyloxycarbonylamino)-3-ethoxy-3-oxo-propanoic acid
| Molecular Formula | C13H15NO6 |
|---|---|
| Molecular Weight | 281.09 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 281.08994 |
| Heavy Atoms | 20 |
| Complexity | 351.0 |
Chemical Identifiers
| CAS Number | 7682-49-7 |
|---|---|
| SMILES | CCOC(=O)C(C(=O)O)NC(=O)OCC1=CC=CC=C1 |
| InChIKey | FIRCAPNAXXIWRP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-carbethoxy-N-(benzyloxycarbonyl)glycine (CAS 7682-49-7), with molecular formula C13H15NO6 and molecular weight 281.09 g/mol. IUPAC: 3-ethoxy-3-oxo-2-(phenylmethoxycarbonylamino)propanoic acid.
Chemical Property Profile of 2-carbethoxy-N-(benzyloxycarbonyl)glycine
Property Insights of 2-carbethoxy-N-(benzyloxycarbonyl)glycine
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-carbethoxy-N-(benzyloxycarbonyl)glycine. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-carbethoxy-N-(benzyloxycarbonyl)glycine. Following Lipinski's Rule of Five, 2-carbethoxy-N-(benzyloxycarbonyl)glycine has 2 hydrogen bond donor(s) and 6 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 2-carbethoxy-N-(benzyloxycarbonyl)glycine?
The CAS number of 2-carbethoxy-N-(benzyloxycarbonyl)glycine is 7682-49-7.
What is the molecular formula of 2-carbethoxy-N-(benzyloxycarbonyl)glycine?
The molecular formula of 2-carbethoxy-N-(benzyloxycarbonyl)glycine is C13H15NO6.
What is the molecular weight of 2-carbethoxy-N-(benzyloxycarbonyl)glycine?
The molecular weight of 2-carbethoxy-N-(benzyloxycarbonyl)glycine is 281.09 g/mol.
Where can I buy 2-carbethoxy-N-(benzyloxycarbonyl)glycine?
You can request a quote for 2-carbethoxy-N-(benzyloxycarbonyl)glycine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-carbethoxy-N-(benzyloxycarbonyl)glycine?
Yes, KEHONG BIO provides custom synthesis services for 2-carbethoxy-N-(benzyloxycarbonyl)glycine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.