Benzoic acid, 4-amino-3-bromo-5-((cyclohexylmethylamino)methyl)-, hydrochloride
TL;DR: Benzoic acid, 4-amino-3-bromo-5-((cyclohexylmethylamino)methyl)-, hydrochloride (CAS 55413-42-8) is a chemical compound with molecular formula C15H22BrClN2O2 and molecular weight 376.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-3-bromo-5-[[cyclohexyl(methyl)amino]methyl]benzoic acid;hydrochloride
Also Known As: Benzoic acid, 4-amino-3-bromo-5-((cyclohexylmethylamino)methyl)-, hydrochloride, 4-Amino-3-bromo-5-((cyclohexylmethylamino)methyl)benzoic acid hydrochloride, 2-Amino-3-brom-5-carboxy-N-cyclohexyl-N-methyl-benzylamin-hydrochlorid [German], 2-Amino-3-brom-5-carboxy-N-cyclohexyl-N-methyl-benzylamin-hydrochlorid, 4-amino-3-bromo-5-[[cyclohexyl(methyl)amino]methyl]benzoic acid hydrochloride
| Molecular Formula | C15H22BrClN2O2 |
|---|---|
| Molecular Weight | 376.06 g/mol |
| LogP | 3.9158 |
| Topological Polar Surface Area | 66.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 376.05533 |
| Heavy Atoms | 21 |
| Complexity | 504.69214 |
Chemical Identifiers
| CAS Number | 55413-42-8 |
|---|---|
| SMILES | CN(CC1=C(C(=CC(=C1)C(=O)O)Br)N)C2CCCCC2.Cl |
Product Overview
Benzoic acid, 4-amino-3-bromo-5-((cyclohexylmethylamino)methyl)-, hydrochloride (CAS 55413-42-8), with molecular formula C15H22BrClN2O2 and molecular weight 376.06 g/mol. IUPAC: 4-amino-3-bromo-5-[[cyclohexyl(methyl)amino]methyl]benzoic acid;hydrochloride.
Chemical Property Profile of Benzoic acid, 4-amino-3-bromo-5-((cyclohexylmethylamino)methyl)-, hydrochloride
Property Insights of Benzoic acid, 4-amino-3-bromo-5-((cyclohexylmethylamino)methyl)-, hydrochloride
The XLogP value of 3.9158 indicates that Benzoic acid, 4-amino-3-bromo-5-((cyclohexylmethylamino)methyl)-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.56 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 4-amino-3-bromo-5-((cyclohexylmethylamino)methyl)-, hydrochloride. Following Lipinski's Rule of Five, Benzoic acid, 4-amino-3-bromo-5-((cyclohexylmethylamino)methyl)-, hydrochloride has 2 hydrogen bond donor(s) and 3 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 Benzoic acid, 4-amino-3-bromo-5-((cyclohexylmethylamino)methyl)-, hydrochloride?
The CAS number of Benzoic acid, 4-amino-3-bromo-5-((cyclohexylmethylamino)methyl)-, hydrochloride is 55413-42-8.
What is the molecular formula of Benzoic acid, 4-amino-3-bromo-5-((cyclohexylmethylamino)methyl)-, hydrochloride?
The molecular formula of Benzoic acid, 4-amino-3-bromo-5-((cyclohexylmethylamino)methyl)-, hydrochloride is C15H22BrClN2O2.
What is the molecular weight of Benzoic acid, 4-amino-3-bromo-5-((cyclohexylmethylamino)methyl)-, hydrochloride?
The molecular weight of Benzoic acid, 4-amino-3-bromo-5-((cyclohexylmethylamino)methyl)-, hydrochloride is 376.06 g/mol.
Where can I buy Benzoic acid, 4-amino-3-bromo-5-((cyclohexylmethylamino)methyl)-, hydrochloride?
You can request a quote for Benzoic acid, 4-amino-3-bromo-5-((cyclohexylmethylamino)methyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 4-amino-3-bromo-5-((cyclohexylmethylamino)methyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 4-amino-3-bromo-5-((cyclohexylmethylamino)methyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.