![2-chloro-N-[[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]benzamide structure](/static/products/4018/401826-95-7.webp)
2-chloro-N-[[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]benzamide
TL;DR: 2-chloro-N-[[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]benzamide (CAS 401826-95-7) is a chemical compound with molecular formula C23H20ClN5O2S and molecular weight 465.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-[[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]benzamide
Also Known As: 2-chloro-N-[[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]benzamide, 2-chloro-N-{[2-(4-ethoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]carbamothioyl}benzamide, 2-chloro-N-[[2-(4-ethoxyphenyl)-6-methyl-benzotriazol-5-yl]thiocarbamoyl]benzamide, (2-chlorophenyl)-N-({[2-(4-ethoxyphenyl)-6-methyl(2-hydrobenzotriazol-5-yl)]am ino}thioxomethyl)carboxamide, 2-chloro-N-((2-(4-ethoxyphenyl)-6-methyl-2H-benzo[d][1,2,3]triazol-5-yl)carbamothioyl)benzamide
| Molecular Formula | C23H20ClN5O2S |
|---|---|
| Molecular Weight | 465.10 g/mol |
| LogP | 4.90782 |
| Topological Polar Surface Area | 81.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 465.10263 |
| Heavy Atoms | 32 |
| Complexity | 1303.7432 |
Chemical Identifiers
| CAS Number | 401826-95-7 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=S)NC(=O)C4=CC=CC=C4Cl)C |
Product Overview
2-chloro-N-[[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]benzamide (CAS 401826-95-7), with molecular formula C23H20ClN5O2S and molecular weight 465.10 g/mol. IUPAC: 2-chloro-N-[[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]benzamide.
Chemical Property Profile of 2-chloro-N-[[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]benzamide
Property Insights of 2-chloro-N-[[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]benzamide
The XLogP value of 4.90782 indicates that 2-chloro-N-[[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.07 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloro-N-[[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]benzamide. Following Lipinski's Rule of Five, 2-chloro-N-[[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]benzamide has 2 hydrogen bond donor(s) and 5 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-chloro-N-[[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]benzamide?
The CAS number of 2-chloro-N-[[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]benzamide is 401826-95-7.
What is the molecular formula of 2-chloro-N-[[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]benzamide?
The molecular formula of 2-chloro-N-[[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]benzamide is C23H20ClN5O2S.
What is the molecular weight of 2-chloro-N-[[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]benzamide?
The molecular weight of 2-chloro-N-[[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]benzamide is 465.10 g/mol.
Where can I buy 2-chloro-N-[[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]benzamide?
You can request a quote for 2-chloro-N-[[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N-[[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-[[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.