N-(2-BROMOPHENYL)-N'-(7-CYANO-1H-BENZOTRIAZOL-4-YL)UREA
TL;DR: N-(2-BROMOPHENYL)-N'-(7-CYANO-1H-BENZOTRIAZOL-4-YL)UREA (CAS 211096-49-0) is a chemical compound with molecular formula C14H9BrN6O and molecular weight 356.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-bromophenyl)-3-(7-cyano-2H-benzotriazol-4-yl)urea
Also Known As: N-(2-BROMOPHENYL)-N'-(7-CYANO-1H-BENZOTRIAZOL-4-YL)UREA, Urea, N-(2-bromophenyl)-N'-(4-cyano-1H-benzotriazol-7-yl)-, Aniline,p-(acetoxymercuri)-N,N-diethyl, 1-(2-Bromophenyl)-3-(4-cyano-1H-benzo[d][1,2,3]triazol-7-yl)urea, 1-(2-bromophenyl)-3-(7-cyano-2H-benzotriazol-4-yl)urea
| Molecular Formula | C14H9BrN6O |
|---|---|
| Molecular Weight | 356.00 g/mol |
| LogP | 3.23608 |
| Topological Polar Surface Area | 106.49 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 356.0021 |
| Heavy Atoms | 22 |
| Complexity | 897.7296 |
Chemical Identifiers
| CAS Number | 211096-49-0 |
|---|---|
| SMILES | C1=CC=C(C(=C1)NC(=O)NC2=CC=C(C3=NNN=C23)C#N)Br |
Product Overview
N-(2-BROMOPHENYL)-N'-(7-CYANO-1H-BENZOTRIAZOL-4-YL)UREA (CAS 211096-49-0), with molecular formula C14H9BrN6O and molecular weight 356.00 g/mol. IUPAC: 1-(2-bromophenyl)-3-(7-cyano-2H-benzotriazol-4-yl)urea.
Chemical Property Profile of N-(2-BROMOPHENYL)-N'-(7-CYANO-1H-BENZOTRIAZOL-4-YL)UREA
Property Insights of N-(2-BROMOPHENYL)-N'-(7-CYANO-1H-BENZOTRIAZOL-4-YL)UREA
The XLogP value of 3.23608 indicates that N-(2-BROMOPHENYL)-N'-(7-CYANO-1H-BENZOTRIAZOL-4-YL)UREA is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.49 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-BROMOPHENYL)-N'-(7-CYANO-1H-BENZOTRIAZOL-4-YL)UREA. Following Lipinski's Rule of Five, N-(2-BROMOPHENYL)-N'-(7-CYANO-1H-BENZOTRIAZOL-4-YL)UREA has 3 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-BROMOPHENYL)-N'-(7-CYANO-1H-BENZOTRIAZOL-4-YL)UREA?
The CAS number of N-(2-BROMOPHENYL)-N'-(7-CYANO-1H-BENZOTRIAZOL-4-YL)UREA is 211096-49-0.
What is the molecular formula of N-(2-BROMOPHENYL)-N'-(7-CYANO-1H-BENZOTRIAZOL-4-YL)UREA?
The molecular formula of N-(2-BROMOPHENYL)-N'-(7-CYANO-1H-BENZOTRIAZOL-4-YL)UREA is C14H9BrN6O.
What is the molecular weight of N-(2-BROMOPHENYL)-N'-(7-CYANO-1H-BENZOTRIAZOL-4-YL)UREA?
The molecular weight of N-(2-BROMOPHENYL)-N'-(7-CYANO-1H-BENZOTRIAZOL-4-YL)UREA is 356.00 g/mol.
Where can I buy N-(2-BROMOPHENYL)-N'-(7-CYANO-1H-BENZOTRIAZOL-4-YL)UREA?
You can request a quote for N-(2-BROMOPHENYL)-N'-(7-CYANO-1H-BENZOTRIAZOL-4-YL)UREA directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-BROMOPHENYL)-N'-(7-CYANO-1H-BENZOTRIAZOL-4-YL)UREA?
Yes, KEHONG BIO provides custom synthesis services for N-(2-BROMOPHENYL)-N'-(7-CYANO-1H-BENZOTRIAZOL-4-YL)UREA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.