2-bromo-N-(3-imidazol-1-ylpropyl)benzamide
TL;DR: 2-bromo-N-(3-imidazol-1-ylpropyl)benzamide (CAS 93668-86-1) is a chemical compound with molecular formula C13H14BrN3O and molecular weight 307.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-N-(3-imidazol-1-ylpropyl)benzamide
Also Known As: 2-bromo-N-(3-imidazol-1-ylpropyl)benzamide, 2-bromo-N-[3-(1H-imidazol-1-yl)propyl]benzamide, BIM-0018963.P001, (2-bromophenyl)-N-(3-imidazolylpropyl)carboxamide
| Molecular Formula | C13H14BrN3O |
|---|---|
| Molecular Weight | 307.03 g/mol |
| LogP | 2.4657 |
| Topological Polar Surface Area | 46.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 307.032 |
| Heavy Atoms | 18 |
| Complexity | 510.71472 |
Chemical Identifiers
| CAS Number | 93668-86-1 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)NCCCN2C=CN=C2)Br |
Product Overview
2-bromo-N-(3-imidazol-1-ylpropyl)benzamide (CAS 93668-86-1), with molecular formula C13H14BrN3O and molecular weight 307.03 g/mol. IUPAC: 2-bromo-N-(3-imidazol-1-ylpropyl)benzamide.
Chemical Property Profile of 2-bromo-N-(3-imidazol-1-ylpropyl)benzamide
Property Insights of 2-bromo-N-(3-imidazol-1-ylpropyl)benzamide
The XLogP value of 2.4657 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-bromo-N-(3-imidazol-1-ylpropyl)benzamide. With a topological polar surface area (TPSA) of 46.92 Ų, 2-bromo-N-(3-imidazol-1-ylpropyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-bromo-N-(3-imidazol-1-ylpropyl)benzamide has 1 hydrogen bond donor(s) and 2 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 2-bromo-N-(3-imidazol-1-ylpropyl)benzamide?
The CAS number of 2-bromo-N-(3-imidazol-1-ylpropyl)benzamide is 93668-86-1.
What is the molecular formula of 2-bromo-N-(3-imidazol-1-ylpropyl)benzamide?
The molecular formula of 2-bromo-N-(3-imidazol-1-ylpropyl)benzamide is C13H14BrN3O.
What is the molecular weight of 2-bromo-N-(3-imidazol-1-ylpropyl)benzamide?
The molecular weight of 2-bromo-N-(3-imidazol-1-ylpropyl)benzamide is 307.03 g/mol.
Where can I buy 2-bromo-N-(3-imidazol-1-ylpropyl)benzamide?
You can request a quote for 2-bromo-N-(3-imidazol-1-ylpropyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-bromo-N-(3-imidazol-1-ylpropyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-bromo-N-(3-imidazol-1-ylpropyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.