![3,4,5-trimethoxy-N-(4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)benzamide structure](/static/products/847/847848-45-7.png)
3,4,5-trimethoxy-N-(4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)benzamide
TL;DR: 3,4,5-trimethoxy-N-(4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)benzamide (CAS 847848-45-7) is a chemical compound with molecular formula C21H21N5O4S and molecular weight 439.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,5-trimethoxy-N-[[4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl]benzamide
Also Known As: 3,4,5-trimethoxy-N-(4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)benzamide, 3,4,5-trimethoxy-N-[4-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl]benzamide, 3,4,5-TRIMETHOXY-N-[(4-{3-METHYL-[1,2,4]TRIAZOLO[3,4-B][1,3,4]THIADIAZOL-6-YL}PHENYL)METHYL]BENZAMIDE, 3,4,5-trimethoxy-N-[[4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl]benzamide
| Molecular Formula | C21H21N5O4S |
|---|---|
| Molecular Weight | 439.13 g/mol |
| LogP | 3.11702 |
| Topological Polar Surface Area | 99.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 439.13144 |
| Heavy Atoms | 31 |
| Complexity | 1207.5328 |
Chemical Identifiers
| CAS Number | 847848-45-7 |
|---|---|
| SMILES | CC1=NN=C2N1N=C(S2)C3=CC=C(C=C3)CNC(=O)C4=CC(=C(C(=C4)OC)OC)OC |
Product Overview
3,4,5-trimethoxy-N-(4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)benzamide (CAS 847848-45-7), with molecular formula C21H21N5O4S and molecular weight 439.13 g/mol. IUPAC: 3,4,5-trimethoxy-N-[[4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl]benzamide.
Chemical Property Profile of 3,4,5-trimethoxy-N-(4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)benzamide
Property Insights of 3,4,5-trimethoxy-N-(4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)benzamide
The XLogP value of 3.11702 indicates that 3,4,5-trimethoxy-N-(4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.87 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4,5-trimethoxy-N-(4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)benzamide. Following Lipinski's Rule of Five, 3,4,5-trimethoxy-N-(4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)benzamide has 1 hydrogen bond donor(s) and 8 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 3,4,5-trimethoxy-N-(4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)benzamide?
The CAS number of 3,4,5-trimethoxy-N-(4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)benzamide is 847848-45-7.
What is the molecular formula of 3,4,5-trimethoxy-N-(4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)benzamide?
The molecular formula of 3,4,5-trimethoxy-N-(4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)benzamide is C21H21N5O4S.
What is the molecular weight of 3,4,5-trimethoxy-N-(4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)benzamide?
The molecular weight of 3,4,5-trimethoxy-N-(4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)benzamide is 439.13 g/mol.
Where can I buy 3,4,5-trimethoxy-N-(4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)benzamide?
You can request a quote for 3,4,5-trimethoxy-N-(4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4,5-trimethoxy-N-(4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3,4,5-trimethoxy-N-(4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.