2-((1-(5-chloro-2-methylphenyl)-1H-tetrazol-5-yl)thio)-N-(2-(6-methoxy-1H-indol-3-yl)ethyl)acetamide
TL;DR: 2-((1-(5-chloro-2-methylphenyl)-1H-tetrazol-5-yl)thio)-N-(2-(6-methoxy-1H-indol-3-yl)ethyl)acetamide (CAS 879591-82-9) is a chemical compound with molecular formula C21H21ClN6O2S and molecular weight 456.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(5-chloro-2-methylphenyl)tetrazol-5-yl]sulfanyl-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]acetamide
Also Known As: 2-((1-(5-chloro-2-methylphenyl)-1H-tetrazol-5-yl)thio)-N-(2-(6-methoxy-1H-indol-3-yl)ethyl)acetamide, 2-[1-(5-chloro-2-methylphenyl)tetrazol-5-yl]sulfanyl-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]acetamide, 2-{[1-(5-chloro-2-methylphenyl)-1H-tetrazol-5-yl]sulfanyl}-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]acetamide
| Molecular Formula | C21H21ClN6O2S |
|---|---|
| Molecular Weight | 456.11 g/mol |
| LogP | 3.56502 |
| Topological Polar Surface Area | 97.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 456.11353 |
| Heavy Atoms | 31 |
| Complexity | 1221.7845 |
Chemical Identifiers
| CAS Number | 879591-82-9 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)Cl)N2C(=NN=N2)SCC(=O)NCCC3=CNC4=C3C=CC(=C4)OC |
Product Overview
2-((1-(5-chloro-2-methylphenyl)-1H-tetrazol-5-yl)thio)-N-(2-(6-methoxy-1H-indol-3-yl)ethyl)acetamide (CAS 879591-82-9), with molecular formula C21H21ClN6O2S and molecular weight 456.11 g/mol. IUPAC: 2-[1-(5-chloro-2-methylphenyl)tetrazol-5-yl]sulfanyl-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]acetamide.
Chemical Property Profile of 2-((1-(5-chloro-2-methylphenyl)-1H-tetrazol-5-yl)thio)-N-(2-(6-methoxy-1H-indol-3-yl)ethyl)acetamide
Property Insights of 2-((1-(5-chloro-2-methylphenyl)-1H-tetrazol-5-yl)thio)-N-(2-(6-methoxy-1H-indol-3-yl)ethyl)acetamide
The XLogP value of 3.56502 indicates that 2-((1-(5-chloro-2-methylphenyl)-1H-tetrazol-5-yl)thio)-N-(2-(6-methoxy-1H-indol-3-yl)ethyl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.72 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((1-(5-chloro-2-methylphenyl)-1H-tetrazol-5-yl)thio)-N-(2-(6-methoxy-1H-indol-3-yl)ethyl)acetamide. Following Lipinski's Rule of Five, 2-((1-(5-chloro-2-methylphenyl)-1H-tetrazol-5-yl)thio)-N-(2-(6-methoxy-1H-indol-3-yl)ethyl)acetamide has 2 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 2-((1-(5-chloro-2-methylphenyl)-1H-tetrazol-5-yl)thio)-N-(2-(6-methoxy-1H-indol-3-yl)ethyl)acetamide?
The CAS number of 2-((1-(5-chloro-2-methylphenyl)-1H-tetrazol-5-yl)thio)-N-(2-(6-methoxy-1H-indol-3-yl)ethyl)acetamide is 879591-82-9.
What is the molecular formula of 2-((1-(5-chloro-2-methylphenyl)-1H-tetrazol-5-yl)thio)-N-(2-(6-methoxy-1H-indol-3-yl)ethyl)acetamide?
The molecular formula of 2-((1-(5-chloro-2-methylphenyl)-1H-tetrazol-5-yl)thio)-N-(2-(6-methoxy-1H-indol-3-yl)ethyl)acetamide is C21H21ClN6O2S.
What is the molecular weight of 2-((1-(5-chloro-2-methylphenyl)-1H-tetrazol-5-yl)thio)-N-(2-(6-methoxy-1H-indol-3-yl)ethyl)acetamide?
The molecular weight of 2-((1-(5-chloro-2-methylphenyl)-1H-tetrazol-5-yl)thio)-N-(2-(6-methoxy-1H-indol-3-yl)ethyl)acetamide is 456.11 g/mol.
Where can I buy 2-((1-(5-chloro-2-methylphenyl)-1H-tetrazol-5-yl)thio)-N-(2-(6-methoxy-1H-indol-3-yl)ethyl)acetamide?
You can request a quote for 2-((1-(5-chloro-2-methylphenyl)-1H-tetrazol-5-yl)thio)-N-(2-(6-methoxy-1H-indol-3-yl)ethyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((1-(5-chloro-2-methylphenyl)-1H-tetrazol-5-yl)thio)-N-(2-(6-methoxy-1H-indol-3-yl)ethyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-((1-(5-chloro-2-methylphenyl)-1H-tetrazol-5-yl)thio)-N-(2-(6-methoxy-1H-indol-3-yl)ethyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.