![N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]-3,4-dimethoxybenzamide structure](/static/products/3473/347339-53-1.webp)
N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]-3,4-dimethoxybenzamide
TL;DR: N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]-3,4-dimethoxybenzamide (CAS 347339-53-1) is a chemical compound with molecular formula C26H27N5O3S and molecular weight 489.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]-3,4-dimethoxybenzamide
Also Known As: N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]-3,4-dimethoxybenzamide, N-{[2-(4-butylphenyl)-2H-benzotriazol-5-yl]carbamothioyl}-3,4-dimethoxybenzamide, 3-[2-(4-BUTYLPHENYL)-1,2,3-BENZOTRIAZOL-5-YL]-1-(3,4-DIMETHOXYBENZOYL)THIOUREA
| Molecular Formula | C26H27N5O3S |
|---|---|
| Molecular Weight | 489.18 g/mol |
| LogP | 4.9071 |
| Topological Polar Surface Area | 90.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 489.18347 |
| Heavy Atoms | 35 |
| Complexity | 1351.1185 |
Chemical Identifiers
| CAS Number | 347339-53-1 |
|---|---|
| SMILES | CCCCC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)C4=CC(=C(C=C4)OC)OC |
Product Overview
N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]-3,4-dimethoxybenzamide (CAS 347339-53-1), with molecular formula C26H27N5O3S and molecular weight 489.18 g/mol. IUPAC: N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]-3,4-dimethoxybenzamide.
Chemical Property Profile of N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]-3,4-dimethoxybenzamide
Property Insights of N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]-3,4-dimethoxybenzamide
The XLogP value of 4.9071 indicates that N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]-3,4-dimethoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]-3,4-dimethoxybenzamide. Following Lipinski's Rule of Five, N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]-3,4-dimethoxybenzamide has 2 hydrogen bond donor(s) and 6 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 N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]-3,4-dimethoxybenzamide?
The CAS number of N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]-3,4-dimethoxybenzamide is 347339-53-1.
What is the molecular formula of N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]-3,4-dimethoxybenzamide?
The molecular formula of N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]-3,4-dimethoxybenzamide is C26H27N5O3S.
What is the molecular weight of N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]-3,4-dimethoxybenzamide?
The molecular weight of N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]-3,4-dimethoxybenzamide is 489.18 g/mol.
Where can I buy N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]-3,4-dimethoxybenzamide?
You can request a quote for N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]-3,4-dimethoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]-3,4-dimethoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]-3,4-dimethoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.