![N-(4-bromobenzoyl)-N'-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]thiourea structure](/static/products/3473/347337-14-8.webp)
N-(4-bromobenzoyl)-N'-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]thiourea
TL;DR: N-(4-bromobenzoyl)-N'-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]thiourea (CAS 347337-14-8) is a chemical compound with molecular formula C22H18BrN5O2S and molecular weight 495.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]benzamide
Also Known As: AN-465/15152248, N-(4-bromobenzoyl)-N'-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]thiourea, 4-bromo-N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]benzamide, 4-bromo-N-{[2-(4-ethoxyphenyl)-2H-benzotriazol-5-yl]carbamothioyl}benzamide, 1-(4-BROMOBENZOYL)-3-[2-(4-ETHOXYPHENYL)-1,2,3-BENZOTRIAZOL-5-YL]THIOUREA
| Molecular Formula | C22H18BrN5O2S |
|---|---|
| Molecular Weight | 495.04 g/mol |
| LogP | 4.7085 |
| Topological Polar Surface Area | 81.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 495.03647 |
| Heavy Atoms | 31 |
| Complexity | 1239.2437 |
Chemical Identifiers
| CAS Number | 347337-14-8 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)C4=CC=C(C=C4)Br |
Product Overview
N-(4-bromobenzoyl)-N'-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]thiourea (CAS 347337-14-8), with molecular formula C22H18BrN5O2S and molecular weight 495.04 g/mol. IUPAC: 4-bromo-N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]benzamide.
Chemical Property Profile of N-(4-bromobenzoyl)-N'-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]thiourea
Property Insights of N-(4-bromobenzoyl)-N'-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]thiourea
The XLogP value of 4.7085 indicates that N-(4-bromobenzoyl)-N'-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]thiourea 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 N-(4-bromobenzoyl)-N'-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]thiourea. Following Lipinski's Rule of Five, N-(4-bromobenzoyl)-N'-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]thiourea 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 N-(4-bromobenzoyl)-N'-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]thiourea?
The CAS number of N-(4-bromobenzoyl)-N'-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]thiourea is 347337-14-8.
What is the molecular formula of N-(4-bromobenzoyl)-N'-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]thiourea?
The molecular formula of N-(4-bromobenzoyl)-N'-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]thiourea is C22H18BrN5O2S.
What is the molecular weight of N-(4-bromobenzoyl)-N'-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]thiourea?
The molecular weight of N-(4-bromobenzoyl)-N'-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]thiourea is 495.04 g/mol.
Where can I buy N-(4-bromobenzoyl)-N'-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]thiourea?
You can request a quote for N-(4-bromobenzoyl)-N'-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-bromobenzoyl)-N'-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for N-(4-bromobenzoyl)-N'-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.