![ethyl (2S)-2-{[(benzyloxy)carbonyl]amino}-3-sulfanylpropanoate structure](/static/products/477/477766-86-2.png)
ethyl (2S)-2-{[(benzyloxy)carbonyl]amino}-3-sulfanylpropanoate
TL;DR: ethyl (2S)-2-{[(benzyloxy)carbonyl]amino}-3-sulfanylpropanoate (CAS 477766-86-2) is a chemical compound with molecular formula C13H17NO4S and molecular weight 283.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2S)-2-(phenylmethoxycarbonylamino)-3-sulfanylpropanoate
Also Known As: N-(Benzyloxycarbonyl)-D-cysteine ethyl ester, J1.895.466D, ethyl (2S)-2-{[(benzyloxy)carbonyl]amino}-3-sulfanylpropanoate, ethyl (2S)-2-(phenylmethoxycarbonylamino)-3-sulfanylpropanoate
| Molecular Formula | C13H17NO4S |
|---|---|
| Molecular Weight | 283.09 g/mol |
| LogP | 1.7743 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 283.08783 |
| Heavy Atoms | 19 |
| Complexity | 410.36407 |
Chemical Identifiers
| CAS Number | 477766-86-2 |
|---|---|
| SMILES | CCOC(=O)[C@@H](CS)NC(=O)OCC1=CC=CC=C1 |
Product Overview
ethyl (2S)-2-{[(benzyloxy)carbonyl]amino}-3-sulfanylpropanoate (CAS 477766-86-2), with molecular formula C13H17NO4S and molecular weight 283.09 g/mol. IUPAC: ethyl (2S)-2-(phenylmethoxycarbonylamino)-3-sulfanylpropanoate.
Chemical Property Profile of ethyl (2S)-2-{[(benzyloxy)carbonyl]amino}-3-sulfanylpropanoate
Property Insights of ethyl (2S)-2-{[(benzyloxy)carbonyl]amino}-3-sulfanylpropanoate
The XLogP value of 1.7743 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl (2S)-2-{[(benzyloxy)carbonyl]amino}-3-sulfanylpropanoate. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl (2S)-2-{[(benzyloxy)carbonyl]amino}-3-sulfanylpropanoate. Following Lipinski's Rule of Five, ethyl (2S)-2-{[(benzyloxy)carbonyl]amino}-3-sulfanylpropanoate 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 ethyl (2S)-2-{[(benzyloxy)carbonyl]amino}-3-sulfanylpropanoate?
The CAS number of ethyl (2S)-2-{[(benzyloxy)carbonyl]amino}-3-sulfanylpropanoate is 477766-86-2.
What is the molecular formula of ethyl (2S)-2-{[(benzyloxy)carbonyl]amino}-3-sulfanylpropanoate?
The molecular formula of ethyl (2S)-2-{[(benzyloxy)carbonyl]amino}-3-sulfanylpropanoate is C13H17NO4S.
What is the molecular weight of ethyl (2S)-2-{[(benzyloxy)carbonyl]amino}-3-sulfanylpropanoate?
The molecular weight of ethyl (2S)-2-{[(benzyloxy)carbonyl]amino}-3-sulfanylpropanoate is 283.09 g/mol.
Where can I buy ethyl (2S)-2-{[(benzyloxy)carbonyl]amino}-3-sulfanylpropanoate?
You can request a quote for ethyl (2S)-2-{[(benzyloxy)carbonyl]amino}-3-sulfanylpropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl (2S)-2-{[(benzyloxy)carbonyl]amino}-3-sulfanylpropanoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl (2S)-2-{[(benzyloxy)carbonyl]amino}-3-sulfanylpropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.