C17H15BrCl2N2O
TL;DR: C17H15BrCl2N2O (CAS 1030028-57-9) is a chemical compound with molecular formula C17H15BrCl2N2O and molecular weight 411.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-(4-bromo-2-chlorophenyl)furan-2-yl]methyl]-1-pyridin-3-ylmethanamine;hydrochloride
Also Known As: 1-(5-(4-bromo-2-chlorophenyl)furan-2-yl)-N-(pyridin-3-ylmethyl)methanamine hydrochloride, 1-[5-(4-bromo-2-chloro-phenyl)-2-furyl]-N-(pyridin-3-ylmethyl)methanamine Hydrochloride, N-[[5-(4-bromo-2-chlorophenyl)furan-2-yl]methyl]-1-pyridin-3-ylmethanamine hydrochloride
| Molecular Formula | C17H15BrCl2N2O |
|---|---|
| Molecular Weight | 411.97 g/mol |
| LogP | 5.4691 |
| Topological Polar Surface Area | 38.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 411.9745 |
| Heavy Atoms | 23 |
| Complexity | 762.29474 |
Chemical Identifiers
| CAS Number | 1030028-57-9 |
|---|---|
| SMILES | C1=CC(=CN=C1)CNCC2=CC=C(O2)C3=C(C=C(C=C3)Br)Cl.Cl |
Product Overview
C17H15BrCl2N2O (CAS 1030028-57-9), with molecular formula C17H15BrCl2N2O and molecular weight 411.97 g/mol. IUPAC: N-[[5-(4-bromo-2-chlorophenyl)furan-2-yl]methyl]-1-pyridin-3-ylmethanamine;hydrochloride.
Chemical Property Profile of C17H15BrCl2N2O
Property Insights of C17H15BrCl2N2O
The XLogP value of 5.4691 indicates that C17H15BrCl2N2O is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.06 Ų, C17H15BrCl2N2O exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C17H15BrCl2N2O has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C17H15BrCl2N2O?
The CAS number of C17H15BrCl2N2O is 1030028-57-9.
What is the molecular formula of C17H15BrCl2N2O?
The molecular formula of C17H15BrCl2N2O is C17H15BrCl2N2O.
What is the molecular weight of C17H15BrCl2N2O?
The molecular weight of C17H15BrCl2N2O is 411.97 g/mol.
Where can I buy C17H15BrCl2N2O?
You can request a quote for C17H15BrCl2N2O directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C17H15BrCl2N2O?
Yes, KEHONG BIO provides custom synthesis services for C17H15BrCl2N2O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.