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Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-sulfamoylpropanoate
TL;DR: Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-sulfamoylpropanoate (CAS 6326-41-6) is a chemical compound with molecular formula C13H18N2O6S and molecular weight 330.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(phenylmethoxycarbonylamino)-3-sulfamoylpropanoate
Also Known As: Ebzcasp, ethyl2- -3-sulfamoylpropionate, ethyl 2-{[(benzyloxy)carbonyl]amino}-3-sulfamoylpropanoate, ethyl 2-(phenylmethoxycarbonylamino)-3-sulfamoylpropanoate, Ethyl ((benzyloxy)carbonyl)(sulfamoyl)alaninate
| Molecular Formula | C13H18N2O6S |
|---|---|
| Molecular Weight | 330.09 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 133.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 330.08856 |
| Heavy Atoms | 22 |
| Complexity | 467.0 |
Chemical Identifiers
| CAS Number | 6326-41-6 |
|---|---|
| SMILES | CCOC(=O)C(CS(=O)(=O)N)NC(=O)OCC1=CC=CC=C1 |
| InChIKey | UGHWFEWPKBZUDZ-UHFFFAOYSA-N |
Product Overview
Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-sulfamoylpropanoate (CAS 6326-41-6), with molecular formula C13H18N2O6S and molecular weight 330.09 g/mol. IUPAC: ethyl 2-(phenylmethoxycarbonylamino)-3-sulfamoylpropanoate.
Chemical Property Profile of Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-sulfamoylpropanoate
Property Insights of Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-sulfamoylpropanoate
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-sulfamoylpropanoate. The TPSA of 133.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-sulfamoylpropanoate. Following Lipinski's Rule of Five, Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-sulfamoylpropanoate has 2 hydrogen bond donor(s) and 7 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 Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-sulfamoylpropanoate?
The CAS number of Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-sulfamoylpropanoate is 6326-41-6.
What is the molecular formula of Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-sulfamoylpropanoate?
The molecular formula of Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-sulfamoylpropanoate is C13H18N2O6S.
What is the molecular weight of Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-sulfamoylpropanoate?
The molecular weight of Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-sulfamoylpropanoate is 330.09 g/mol.
Where can I buy Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-sulfamoylpropanoate?
You can request a quote for Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-sulfamoylpropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-sulfamoylpropanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-{[(benzyloxy)carbonyl]amino}-3-sulfamoylpropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.