![N-[(Ethylsulfanyl)carbonothioyl]alanine structure](/static/products/7056/70561-60-3.webp)
N-[(Ethylsulfanyl)carbonothioyl]alanine
TL;DR: N-[(Ethylsulfanyl)carbonothioyl]alanine (CAS 70561-60-3) is a chemical compound with molecular formula C6H11NO2S2 and molecular weight 193.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(ethylsulfanylcarbothioylamino)propanoic acid
Also Known As: N-(ethylthiothiocarbonyl)-DL-alanine, N-[(Ethylsulfanyl)carbonothioyl]alanine, N-[(Ethylsulfanyl)carbothioyl]alanine, 2-(ethylsulfanylcarbothioylamino)propanoic acid
| Molecular Formula | C6H11NO2S2 |
|---|---|
| Molecular Weight | 193.02 g/mol |
| LogP | 1.0871 |
| Topological Polar Surface Area | 49.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 193.02312 |
| Heavy Atoms | 11 |
| Complexity | 160.66127 |
Chemical Identifiers
| CAS Number | 70561-60-3 |
|---|---|
| SMILES | CCSC(=S)NC(C)C(=O)O |
Product Overview
N-[(Ethylsulfanyl)carbonothioyl]alanine (CAS 70561-60-3), with molecular formula C6H11NO2S2 and molecular weight 193.02 g/mol. IUPAC: 2-(ethylsulfanylcarbothioylamino)propanoic acid.
Chemical Property Profile of N-[(Ethylsulfanyl)carbonothioyl]alanine
Property Insights of N-[(Ethylsulfanyl)carbonothioyl]alanine
The XLogP value of 1.0871 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(Ethylsulfanyl)carbonothioyl]alanine. With a topological polar surface area (TPSA) of 49.33 Ų, N-[(Ethylsulfanyl)carbonothioyl]alanine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(Ethylsulfanyl)carbonothioyl]alanine has 2 hydrogen bond donor(s) and 3 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 N-[(Ethylsulfanyl)carbonothioyl]alanine?
The CAS number of N-[(Ethylsulfanyl)carbonothioyl]alanine is 70561-60-3.
What is the molecular formula of N-[(Ethylsulfanyl)carbonothioyl]alanine?
The molecular formula of N-[(Ethylsulfanyl)carbonothioyl]alanine is C6H11NO2S2.
What is the molecular weight of N-[(Ethylsulfanyl)carbonothioyl]alanine?
The molecular weight of N-[(Ethylsulfanyl)carbonothioyl]alanine is 193.02 g/mol.
Where can I buy N-[(Ethylsulfanyl)carbonothioyl]alanine?
You can request a quote for N-[(Ethylsulfanyl)carbonothioyl]alanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(Ethylsulfanyl)carbonothioyl]alanine?
Yes, KEHONG BIO provides custom synthesis services for N-[(Ethylsulfanyl)carbonothioyl]alanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.