![4-methoxy-N-((4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)carbamothioyl)benzamide structure](/static/products/899/899401-51-5.png)
4-methoxy-N-((4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)carbamothioyl)benzamide
TL;DR: 4-methoxy-N-((4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)carbamothioyl)benzamide (CAS 899401-51-5) is a chemical compound with molecular formula C20H18N6O2S2 and molecular weight 438.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-N-[[4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methylcarbamothioyl]benzamide
Also Known As: 4-methoxy-N-((4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)carbamothioyl)benzamide, 4-methoxy-N-[[4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methylcarbamothioyl]benzamide, 4-methoxy-N-{[4-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl]carbamothioyl}benzamide
| Molecular Formula | C20H18N6O2S2 |
|---|---|
| Molecular Weight | 438.09 g/mol |
| LogP | 2.97432 |
| Topological Polar Surface Area | 93.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 438.09326 |
| Heavy Atoms | 30 |
| Complexity | 1198.5027 |
Chemical Identifiers
| CAS Number | 899401-51-5 |
|---|---|
| SMILES | CC1=NN=C2N1N=C(S2)C3=CC=C(C=C3)CNC(=S)NC(=O)C4=CC=C(C=C4)OC |
Product Overview
4-methoxy-N-((4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)carbamothioyl)benzamide (CAS 899401-51-5), with molecular formula C20H18N6O2S2 and molecular weight 438.09 g/mol. IUPAC: 4-methoxy-N-[[4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methylcarbamothioyl]benzamide.
Chemical Property Profile of 4-methoxy-N-((4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)carbamothioyl)benzamide
Property Insights of 4-methoxy-N-((4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)carbamothioyl)benzamide
The XLogP value of 2.97432 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-methoxy-N-((4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)carbamothioyl)benzamide. The TPSA of 93.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-methoxy-N-((4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)carbamothioyl)benzamide. Following Lipinski's Rule of Five, 4-methoxy-N-((4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)carbamothioyl)benzamide has 2 hydrogen bond donor(s) and 7 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 4-methoxy-N-((4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)carbamothioyl)benzamide?
The CAS number of 4-methoxy-N-((4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)carbamothioyl)benzamide is 899401-51-5.
What is the molecular formula of 4-methoxy-N-((4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)carbamothioyl)benzamide?
The molecular formula of 4-methoxy-N-((4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)carbamothioyl)benzamide is C20H18N6O2S2.
What is the molecular weight of 4-methoxy-N-((4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)carbamothioyl)benzamide?
The molecular weight of 4-methoxy-N-((4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)carbamothioyl)benzamide is 438.09 g/mol.
Where can I buy 4-methoxy-N-((4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)carbamothioyl)benzamide?
You can request a quote for 4-methoxy-N-((4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)carbamothioyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methoxy-N-((4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)carbamothioyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-methoxy-N-((4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl)carbamothioyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.