2,4-dichloro-N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]benzamide
TL;DR: 2,4-dichloro-N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]benzamide (CAS 428841-70-7) is a chemical compound with molecular formula C22H17Cl2N5O2S and molecular weight 485.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dichloro-N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]benzamide
Also Known As: AN-465/40769688, 2,4-dichloro-N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]benzamide, 2,4-dichloro-N-{[2-(4-ethoxyphenyl)-2H-benzotriazol-5-yl]carbamothioyl}benzamide, 1-(2,4-DICHLOROBENZOYL)-3-[2-(4-ETHOXYPHENYL)-1,2,3-BENZOTRIAZOL-5-YL]THIOUREA, N-(2,4-dichlorobenzoyl)-N'-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]thiourea
| Molecular Formula | C22H17Cl2N5O2S |
|---|---|
| Molecular Weight | 485.05 g/mol |
| LogP | 5.2528 |
| Topological Polar Surface Area | 81.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 485.048 |
| Heavy Atoms | 32 |
| Complexity | 1307.6776 |
Chemical Identifiers
| CAS Number | 428841-70-7 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)C4=C(C=C(C=C4)Cl)Cl |
Product Overview
2,4-dichloro-N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]benzamide (CAS 428841-70-7), with molecular formula C22H17Cl2N5O2S and molecular weight 485.05 g/mol. IUPAC: 2,4-dichloro-N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]benzamide.
Chemical Property Profile of 2,4-dichloro-N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]benzamide
Property Insights of 2,4-dichloro-N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]benzamide
The XLogP value of 5.2528 indicates that 2,4-dichloro-N-[[2-(4-ethoxyphenyl)benzotriazol-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 2,4-dichloro-N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]benzamide. Following Lipinski's Rule of Five, 2,4-dichloro-N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]benzamide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,4-dichloro-N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]benzamide?
The CAS number of 2,4-dichloro-N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]benzamide is 428841-70-7.
What is the molecular formula of 2,4-dichloro-N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]benzamide?
The molecular formula of 2,4-dichloro-N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]benzamide is C22H17Cl2N5O2S.
What is the molecular weight of 2,4-dichloro-N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]benzamide?
The molecular weight of 2,4-dichloro-N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]benzamide is 485.05 g/mol.
Where can I buy 2,4-dichloro-N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]benzamide?
You can request a quote for 2,4-dichloro-N-[[2-(4-ethoxyphenyl)benzotriazol-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 2,4-dichloro-N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2,4-dichloro-N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.