Homozimelidine
TL;DR: Homozimelidine (CAS 112969-65-0) is a chemical compound with molecular formula C19H21BrN2O4 and molecular weight 420.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-4-(4-bromophenyl)-N,N-dimethyl-4-pyridin-3-ylbut-3-en-1-amine;oxalic acid
Also Known As: Homomineldine, Homozimelidine, (E)-4-(4-bromophenyl)-N,N-dimethyl-4-pyridin-3-ylbut-3-en-1-amine, (E)-4-(4-bromophenyl)-N,N-dimethyl-4-pyridin-3-ylbut-3-en-1-amine,oxalic acid, (E)-4-(4-bromophenyl)-N,N-dimethyl-4-pyridin-3-ylbut-3-en-1-amine; oxalic acid
| Molecular Formula | C19H21BrN2O4 |
|---|---|
| Molecular Weight | 420.07 g/mol |
| LogP | 3.3831 |
| Topological Polar Surface Area | 90.73 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 420.06848 |
| Heavy Atoms | 26 |
| Complexity | 731.8942 |
Chemical Identifiers
| CAS Number | 112969-65-0 |
|---|---|
| SMILES | CN(C)CC/C=C(\C1=CC=C(C=C1)Br)/C2=CN=CC=C2.C(=O)(C(=O)O)O |
Product Overview
Homozimelidine (CAS 112969-65-0), with molecular formula C19H21BrN2O4 and molecular weight 420.07 g/mol. IUPAC: (E)-4-(4-bromophenyl)-N,N-dimethyl-4-pyridin-3-ylbut-3-en-1-amine;oxalic acid.
Chemical Property Profile of Homozimelidine
Property Insights of Homozimelidine
The XLogP value of 3.3831 indicates that Homozimelidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.73 Ų falls within the moderate polarity range, balancing permeability and solubility for Homozimelidine. Following Lipinski's Rule of Five, Homozimelidine has 2 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 Homozimelidine?
The CAS number of Homozimelidine is 112969-65-0.
What is the molecular formula of Homozimelidine?
The molecular formula of Homozimelidine is C19H21BrN2O4.
What is the molecular weight of Homozimelidine?
The molecular weight of Homozimelidine is 420.07 g/mol.
Where can I buy Homozimelidine?
You can request a quote for Homozimelidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Homozimelidine?
Yes, KEHONG BIO provides custom synthesis services for Homozimelidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.