![ethyl N-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}glycinate structure](/static/products/849/849002-65-9.png)
ethyl N-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}glycinate
TL;DR: ethyl N-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}glycinate (CAS 849002-65-9) is a chemical compound with molecular formula C15H18N4O3S and molecular weight 334.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]acetate
Also Known As: ethyl 2-(2-((4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)thio)acetamido)acetate, ethyl 2-[[2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]acetate, ethyl N-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}glycinate
| Molecular Formula | C15H18N4O3S |
|---|---|
| Molecular Weight | 334.11 g/mol |
| LogP | 1.2535 |
| Topological Polar Surface Area | 86.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 334.10995 |
| Heavy Atoms | 23 |
| Complexity | 672.61646 |
Chemical Identifiers
| CAS Number | 849002-65-9 |
|---|---|
| SMILES | CCOC(=O)CNC(=O)CSC1=NN=C(N1C)C2=CC=CC=C2 |
Product Overview
ethyl N-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}glycinate (CAS 849002-65-9), with molecular formula C15H18N4O3S and molecular weight 334.11 g/mol. IUPAC: ethyl 2-[[2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]acetate.
Chemical Property Profile of ethyl N-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}glycinate
Property Insights of ethyl N-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}glycinate
The XLogP value of 1.2535 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl N-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}glycinate. The TPSA of 86.11 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl N-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}glycinate. Following Lipinski's Rule of Five, ethyl N-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}glycinate has 1 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 ethyl N-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}glycinate?
The CAS number of ethyl N-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}glycinate is 849002-65-9.
What is the molecular formula of ethyl N-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}glycinate?
The molecular formula of ethyl N-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}glycinate is C15H18N4O3S.
What is the molecular weight of ethyl N-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}glycinate?
The molecular weight of ethyl N-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}glycinate is 334.11 g/mol.
Where can I buy ethyl N-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}glycinate?
You can request a quote for ethyl N-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}glycinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl N-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}glycinate?
Yes, KEHONG BIO provides custom synthesis services for ethyl N-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}glycinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.