![3-chloro-N-[[2-(4-chlorophenyl)benzotriazol-5-yl]carbamothioyl]-4-methoxybenzamide structure](/static/products/3812/381201-74-7.webp)
3-chloro-N-[[2-(4-chlorophenyl)benzotriazol-5-yl]carbamothioyl]-4-methoxybenzamide
TL;DR: 3-chloro-N-[[2-(4-chlorophenyl)benzotriazol-5-yl]carbamothioyl]-4-methoxybenzamide (CAS 381201-74-7) is a chemical compound with molecular formula C21H15Cl2N5O2S and molecular weight 471.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-[[2-(4-chlorophenyl)benzotriazol-5-yl]carbamothioyl]-4-methoxybenzamide
Also Known As: 3-chloro-N-[[2-(4-chlorophenyl)benzotriazol-5-yl]carbamothioyl]-4-methoxybenzamide, 3-chloro-N-[[2-(4-chlorophenyl)benzotriazol-5-yl]thiocarbamoyl]-4-methoxy-benzamide, 3-chloro-N-{[2-(4-chlorophenyl)-2H-benzotriazol-5-yl]carbamothioyl}-4-methoxybenzamide, 3-chloro-N-((2-(4-chlorophenyl)-2H-benzo[d][1,2,3]triazol-5-yl)carbamothioyl)-4-methoxybenzamide
| Molecular Formula | C21H15Cl2N5O2S |
|---|---|
| Molecular Weight | 471.03 g/mol |
| LogP | 4.8627 |
| Topological Polar Surface Area | 81.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 471.03235 |
| Heavy Atoms | 31 |
| Complexity | 1290.9247 |
Chemical Identifiers
| CAS Number | 381201-74-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC3=NN(N=C3C=C2)C4=CC=C(C=C4)Cl)Cl |
Product Overview
3-chloro-N-[[2-(4-chlorophenyl)benzotriazol-5-yl]carbamothioyl]-4-methoxybenzamide (CAS 381201-74-7), with molecular formula C21H15Cl2N5O2S and molecular weight 471.03 g/mol. IUPAC: 3-chloro-N-[[2-(4-chlorophenyl)benzotriazol-5-yl]carbamothioyl]-4-methoxybenzamide.
Chemical Property Profile of 3-chloro-N-[[2-(4-chlorophenyl)benzotriazol-5-yl]carbamothioyl]-4-methoxybenzamide
Property Insights of 3-chloro-N-[[2-(4-chlorophenyl)benzotriazol-5-yl]carbamothioyl]-4-methoxybenzamide
The XLogP value of 4.8627 indicates that 3-chloro-N-[[2-(4-chlorophenyl)benzotriazol-5-yl]carbamothioyl]-4-methoxybenzamide 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 3-chloro-N-[[2-(4-chlorophenyl)benzotriazol-5-yl]carbamothioyl]-4-methoxybenzamide. Following Lipinski's Rule of Five, 3-chloro-N-[[2-(4-chlorophenyl)benzotriazol-5-yl]carbamothioyl]-4-methoxybenzamide 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 3-chloro-N-[[2-(4-chlorophenyl)benzotriazol-5-yl]carbamothioyl]-4-methoxybenzamide?
The CAS number of 3-chloro-N-[[2-(4-chlorophenyl)benzotriazol-5-yl]carbamothioyl]-4-methoxybenzamide is 381201-74-7.
What is the molecular formula of 3-chloro-N-[[2-(4-chlorophenyl)benzotriazol-5-yl]carbamothioyl]-4-methoxybenzamide?
The molecular formula of 3-chloro-N-[[2-(4-chlorophenyl)benzotriazol-5-yl]carbamothioyl]-4-methoxybenzamide is C21H15Cl2N5O2S.
What is the molecular weight of 3-chloro-N-[[2-(4-chlorophenyl)benzotriazol-5-yl]carbamothioyl]-4-methoxybenzamide?
The molecular weight of 3-chloro-N-[[2-(4-chlorophenyl)benzotriazol-5-yl]carbamothioyl]-4-methoxybenzamide is 471.03 g/mol.
Where can I buy 3-chloro-N-[[2-(4-chlorophenyl)benzotriazol-5-yl]carbamothioyl]-4-methoxybenzamide?
You can request a quote for 3-chloro-N-[[2-(4-chlorophenyl)benzotriazol-5-yl]carbamothioyl]-4-methoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-chloro-N-[[2-(4-chlorophenyl)benzotriazol-5-yl]carbamothioyl]-4-methoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-N-[[2-(4-chlorophenyl)benzotriazol-5-yl]carbamothioyl]-4-methoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.