3-bromo-N-(2-(2-(4-(4-fluorophenyl)piperazin-1-yl)ethyl)-1-methyl-1H-benzo[d]imidazol-5-yl)benzamide
TL;DR: 3-bromo-N-(2-(2-(4-(4-fluorophenyl)piperazin-1-yl)ethyl)-1-methyl-1H-benzo[d]imidazol-5-yl)benzamide (CAS 899412-23-8) is a chemical compound with molecular formula C27H27BrFN5O and molecular weight 535.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-N-[2-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]-1-methylbenzimidazol-5-yl]benzamide
Also Known As: 3-bromo-N-(2-(2-(4-(4-fluorophenyl)piperazin-1-yl)ethyl)-1-methyl-1H-benzo[d]imidazol-5-yl)benzamide, 3-bromo-N-(2-{2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl}-1-methyl-1H-benzimidazol-5-yl)benzamide, 3-bromo-N-[2-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]-1-methyl-benzoimidazol-5-yl]benzamide, 3-bromo-N-[2-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]-1-methylbenzimidazol-5-yl]benzamide
| Molecular Formula | C27H27BrFN5O |
|---|---|
| Molecular Weight | 535.14 g/mol |
| LogP | 5.0919 |
| Topological Polar Surface Area | 53.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 535.1383 |
| Heavy Atoms | 35 |
| Complexity | 1345.7029 |
Chemical Identifiers
| CAS Number | 899412-23-8 |
|---|---|
| SMILES | CN1C2=C(C=C(C=C2)NC(=O)C3=CC(=CC=C3)Br)N=C1CCN4CCN(CC4)C5=CC=C(C=C5)F |
Product Overview
3-bromo-N-(2-(2-(4-(4-fluorophenyl)piperazin-1-yl)ethyl)-1-methyl-1H-benzo[d]imidazol-5-yl)benzamide (CAS 899412-23-8), with molecular formula C27H27BrFN5O and molecular weight 535.14 g/mol. IUPAC: 3-bromo-N-[2-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]-1-methylbenzimidazol-5-yl]benzamide.
Chemical Property Profile of 3-bromo-N-(2-(2-(4-(4-fluorophenyl)piperazin-1-yl)ethyl)-1-methyl-1H-benzo[d]imidazol-5-yl)benzamide
Property Insights of 3-bromo-N-(2-(2-(4-(4-fluorophenyl)piperazin-1-yl)ethyl)-1-methyl-1H-benzo[d]imidazol-5-yl)benzamide
The XLogP value of 5.0919 indicates that 3-bromo-N-(2-(2-(4-(4-fluorophenyl)piperazin-1-yl)ethyl)-1-methyl-1H-benzo[d]imidazol-5-yl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.4 Ų, 3-bromo-N-(2-(2-(4-(4-fluorophenyl)piperazin-1-yl)ethyl)-1-methyl-1H-benzo[d]imidazol-5-yl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-bromo-N-(2-(2-(4-(4-fluorophenyl)piperazin-1-yl)ethyl)-1-methyl-1H-benzo[d]imidazol-5-yl)benzamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-bromo-N-(2-(2-(4-(4-fluorophenyl)piperazin-1-yl)ethyl)-1-methyl-1H-benzo[d]imidazol-5-yl)benzamide?
The CAS number of 3-bromo-N-(2-(2-(4-(4-fluorophenyl)piperazin-1-yl)ethyl)-1-methyl-1H-benzo[d]imidazol-5-yl)benzamide is 899412-23-8.
What is the molecular formula of 3-bromo-N-(2-(2-(4-(4-fluorophenyl)piperazin-1-yl)ethyl)-1-methyl-1H-benzo[d]imidazol-5-yl)benzamide?
The molecular formula of 3-bromo-N-(2-(2-(4-(4-fluorophenyl)piperazin-1-yl)ethyl)-1-methyl-1H-benzo[d]imidazol-5-yl)benzamide is C27H27BrFN5O.
What is the molecular weight of 3-bromo-N-(2-(2-(4-(4-fluorophenyl)piperazin-1-yl)ethyl)-1-methyl-1H-benzo[d]imidazol-5-yl)benzamide?
The molecular weight of 3-bromo-N-(2-(2-(4-(4-fluorophenyl)piperazin-1-yl)ethyl)-1-methyl-1H-benzo[d]imidazol-5-yl)benzamide is 535.14 g/mol.
Where can I buy 3-bromo-N-(2-(2-(4-(4-fluorophenyl)piperazin-1-yl)ethyl)-1-methyl-1H-benzo[d]imidazol-5-yl)benzamide?
You can request a quote for 3-bromo-N-(2-(2-(4-(4-fluorophenyl)piperazin-1-yl)ethyl)-1-methyl-1H-benzo[d]imidazol-5-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-bromo-N-(2-(2-(4-(4-fluorophenyl)piperazin-1-yl)ethyl)-1-methyl-1H-benzo[d]imidazol-5-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-bromo-N-(2-(2-(4-(4-fluorophenyl)piperazin-1-yl)ethyl)-1-methyl-1H-benzo[d]imidazol-5-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.