N1-((4-Bromophenyl)methyl)-N2,N2-dimethyl-N1-2-pyridinyl-1,2-ethanediamine
TL;DR: N1-((4-Bromophenyl)methyl)-N2,N2-dimethyl-N1-2-pyridinyl-1,2-ethanediamine (CAS 531-09-9) is a chemical compound with molecular formula C16H20BrN3 and molecular weight 333.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-[(4-bromophenyl)methyl]-N,N-dimethyl-N'-pyridin-2-ylethane-1,2-diamine
Also Known As: Hibernon, Bromopyramine, 4-Bromtripelennamin, p-Bromtripelennamine, N'-[(4-bromophenyl)methyl]-N,N-dimethyl-N'-pyridin-2-ylethane-1,2-diamine
| Molecular Formula | C16H20BrN3 |
|---|---|
| Molecular Weight | 333.08 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 19.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 333.08405 |
| Heavy Atoms | 20 |
| Complexity | 264.0 |
Chemical Identifiers
| CAS Number | 531-09-9 |
|---|---|
| SMILES | CN(C)CCN(CC1=CC=C(C=C1)Br)C2=CC=CC=N2 |
| InChIKey | HMNAUVJMDBFVAJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N1-((4-Bromophenyl)methyl)-N2,N2-dimethyl-N1-2-pyridinyl-1,2-ethanediamine (CAS 531-09-9), with molecular formula C16H20BrN3 and molecular weight 333.08 g/mol. IUPAC: N'-[(4-bromophenyl)methyl]-N,N-dimethyl-N'-pyridin-2-ylethane-1,2-diamine.
Chemical Property Profile of N1-((4-Bromophenyl)methyl)-N2,N2-dimethyl-N1-2-pyridinyl-1,2-ethanediamine
Property Insights of N1-((4-Bromophenyl)methyl)-N2,N2-dimethyl-N1-2-pyridinyl-1,2-ethanediamine
The XLogP value of 4.0 indicates that N1-((4-Bromophenyl)methyl)-N2,N2-dimethyl-N1-2-pyridinyl-1,2-ethanediamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 19.4 Ų, N1-((4-Bromophenyl)methyl)-N2,N2-dimethyl-N1-2-pyridinyl-1,2-ethanediamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N1-((4-Bromophenyl)methyl)-N2,N2-dimethyl-N1-2-pyridinyl-1,2-ethanediamine has 0 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 N1-((4-Bromophenyl)methyl)-N2,N2-dimethyl-N1-2-pyridinyl-1,2-ethanediamine?
The CAS number of N1-((4-Bromophenyl)methyl)-N2,N2-dimethyl-N1-2-pyridinyl-1,2-ethanediamine is 531-09-9.
What is the molecular formula of N1-((4-Bromophenyl)methyl)-N2,N2-dimethyl-N1-2-pyridinyl-1,2-ethanediamine?
The molecular formula of N1-((4-Bromophenyl)methyl)-N2,N2-dimethyl-N1-2-pyridinyl-1,2-ethanediamine is C16H20BrN3.
What is the molecular weight of N1-((4-Bromophenyl)methyl)-N2,N2-dimethyl-N1-2-pyridinyl-1,2-ethanediamine?
The molecular weight of N1-((4-Bromophenyl)methyl)-N2,N2-dimethyl-N1-2-pyridinyl-1,2-ethanediamine is 333.08 g/mol.
Where can I buy N1-((4-Bromophenyl)methyl)-N2,N2-dimethyl-N1-2-pyridinyl-1,2-ethanediamine?
You can request a quote for N1-((4-Bromophenyl)methyl)-N2,N2-dimethyl-N1-2-pyridinyl-1,2-ethanediamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N1-((4-Bromophenyl)methyl)-N2,N2-dimethyl-N1-2-pyridinyl-1,2-ethanediamine?
Yes, KEHONG BIO provides custom synthesis services for N1-((4-Bromophenyl)methyl)-N2,N2-dimethyl-N1-2-pyridinyl-1,2-ethanediamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.