![N-[[2-(4-ethylphenyl)benzotriazol-5-yl]carbamothioyl]propanamide structure](/static/products/4304/430447-84-0.webp)
N-[[2-(4-ethylphenyl)benzotriazol-5-yl]carbamothioyl]propanamide
TL;DR: N-[[2-(4-ethylphenyl)benzotriazol-5-yl]carbamothioyl]propanamide (CAS 430447-84-0) is a chemical compound with molecular formula C18H19N5OS and molecular weight 353.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[2-(4-ethylphenyl)benzotriazol-5-yl]carbamothioyl]propanamide
Also Known As: N-[[2-(4-ethylphenyl)benzotriazol-5-yl]carbamothioyl]propanamide, N-{[2-(4-ethylphenyl)-2H-benzotriazol-5-yl]carbamothioyl}propanamide, N-[2-(4-ethylphenyl)-2H-1,2,3-benzotriazol-5-yl]-N'-propionylthiourea
| Molecular Formula | C18H19N5OS |
|---|---|
| Molecular Weight | 353.13 g/mol |
| LogP | 3.2059 |
| Topological Polar Surface Area | 71.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 353.13104 |
| Heavy Atoms | 25 |
| Complexity | 916.866 |
Chemical Identifiers
| CAS Number | 430447-84-0 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)CC |
Product Overview
N-[[2-(4-ethylphenyl)benzotriazol-5-yl]carbamothioyl]propanamide (CAS 430447-84-0), with molecular formula C18H19N5OS and molecular weight 353.13 g/mol. IUPAC: N-[[2-(4-ethylphenyl)benzotriazol-5-yl]carbamothioyl]propanamide.
Chemical Property Profile of N-[[2-(4-ethylphenyl)benzotriazol-5-yl]carbamothioyl]propanamide
Property Insights of N-[[2-(4-ethylphenyl)benzotriazol-5-yl]carbamothioyl]propanamide
The XLogP value of 3.2059 indicates that N-[[2-(4-ethylphenyl)benzotriazol-5-yl]carbamothioyl]propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.84 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[[2-(4-ethylphenyl)benzotriazol-5-yl]carbamothioyl]propanamide. Following Lipinski's Rule of Five, N-[[2-(4-ethylphenyl)benzotriazol-5-yl]carbamothioyl]propanamide has 2 hydrogen bond donor(s) and 4 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-ethylphenyl)benzotriazol-5-yl]carbamothioyl]propanamide?
The CAS number of N-[[2-(4-ethylphenyl)benzotriazol-5-yl]carbamothioyl]propanamide is 430447-84-0.
What is the molecular formula of N-[[2-(4-ethylphenyl)benzotriazol-5-yl]carbamothioyl]propanamide?
The molecular formula of N-[[2-(4-ethylphenyl)benzotriazol-5-yl]carbamothioyl]propanamide is C18H19N5OS.
What is the molecular weight of N-[[2-(4-ethylphenyl)benzotriazol-5-yl]carbamothioyl]propanamide?
The molecular weight of N-[[2-(4-ethylphenyl)benzotriazol-5-yl]carbamothioyl]propanamide is 353.13 g/mol.
Where can I buy N-[[2-(4-ethylphenyl)benzotriazol-5-yl]carbamothioyl]propanamide?
You can request a quote for N-[[2-(4-ethylphenyl)benzotriazol-5-yl]carbamothioyl]propanamide 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-ethylphenyl)benzotriazol-5-yl]carbamothioyl]propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[2-(4-ethylphenyl)benzotriazol-5-yl]carbamothioyl]propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.