Ethyl 2-(phenylsulfanylcarbonylamino)acetate
TL;DR: Ethyl 2-(phenylsulfanylcarbonylamino)acetate (CAS 4910-26-3) is a chemical compound with molecular formula C11H13NO3S and molecular weight 239.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(phenylsulfanylcarbonylamino)acetate
Also Known As: ethyl 2-(phenylsulfanylcarbonylamino)acetate, N-Phenylmercaptocarbonyl-glycin-aethylester, Ethyl N-[(phenylsulfanyl)carbonyl]glycinate, N-phenylsulfanylcarbonyl-glycine ethyl ester
| Molecular Formula | C11H13NO3S |
|---|---|
| Molecular Weight | 239.06 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 80.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 239.06161 |
| Heavy Atoms | 16 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 4910-26-3 |
|---|---|
| SMILES | CCOC(=O)CNC(=O)SC1=CC=CC=C1 |
| InChIKey | XJFIXGUSZKDBQP-UHFFFAOYSA-N |
Product Overview
Ethyl 2-(phenylsulfanylcarbonylamino)acetate (CAS 4910-26-3), with molecular formula C11H13NO3S and molecular weight 239.06 g/mol. IUPAC: ethyl 2-(phenylsulfanylcarbonylamino)acetate.
Chemical Property Profile of Ethyl 2-(phenylsulfanylcarbonylamino)acetate
Property Insights of Ethyl 2-(phenylsulfanylcarbonylamino)acetate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-(phenylsulfanylcarbonylamino)acetate. The TPSA of 80.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-(phenylsulfanylcarbonylamino)acetate. Following Lipinski's Rule of Five, Ethyl 2-(phenylsulfanylcarbonylamino)acetate has 1 hydrogen bond donor(s) and 4 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-(phenylsulfanylcarbonylamino)acetate?
The CAS number of Ethyl 2-(phenylsulfanylcarbonylamino)acetate is 4910-26-3.
What is the molecular formula of Ethyl 2-(phenylsulfanylcarbonylamino)acetate?
The molecular formula of Ethyl 2-(phenylsulfanylcarbonylamino)acetate is C11H13NO3S.
What is the molecular weight of Ethyl 2-(phenylsulfanylcarbonylamino)acetate?
The molecular weight of Ethyl 2-(phenylsulfanylcarbonylamino)acetate is 239.06 g/mol.
Where can I buy Ethyl 2-(phenylsulfanylcarbonylamino)acetate?
You can request a quote for Ethyl 2-(phenylsulfanylcarbonylamino)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(phenylsulfanylcarbonylamino)acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(phenylsulfanylcarbonylamino)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.