BAS 00163854
TL;DR: BAS 00163854 (CAS 304446-53-5) is a chemical compound with molecular formula C26H20BrNO2 and molecular weight 457.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1-(6-bromo-2-methyl-4-phenylquinolin-3-yl)-3-(2-methoxyphenyl)prop-2-en-1-one
Also Known As: BAS 00163854, A2177/0091481, (2E)-1-(6-bromo-2-methyl-4-phenylquinolin-3-yl)-3-(2-methoxyphenyl)prop-2-en-1-one, (E)-1-(6-bromo-2-methyl-4-phenylquinolin-3-yl)-3-(2-methoxyphenyl)prop-2-en-1-one, 1-(6-Bromo-2-methyl-4-phenyl-quinolin-3-yl)-3-(2-methoxy-phenyl)-propenone
| Molecular Formula | C26H20BrNO2 |
|---|---|
| Molecular Weight | 457.07 g/mol |
| LogP | 6.87742 |
| Topological Polar Surface Area | 39.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 457.06775 |
| Heavy Atoms | 30 |
| Complexity | 1263.0183 |
Chemical Identifiers
| CAS Number | 304446-53-5 |
|---|---|
| SMILES | CC1=C(C(=C2C=C(C=CC2=N1)Br)C3=CC=CC=C3)C(=O)/C=C/C4=CC=CC=C4OC |
Product Overview
BAS 00163854 (CAS 304446-53-5), with molecular formula C26H20BrNO2 and molecular weight 457.07 g/mol. IUPAC: (E)-1-(6-bromo-2-methyl-4-phenylquinolin-3-yl)-3-(2-methoxyphenyl)prop-2-en-1-one.
Chemical Property Profile of BAS 00163854
Property Insights of BAS 00163854
The XLogP value of 6.87742 indicates that BAS 00163854 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.19 Ų, BAS 00163854 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00163854 has 0 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 BAS 00163854?
The CAS number of BAS 00163854 is 304446-53-5.
What is the molecular formula of BAS 00163854?
The molecular formula of BAS 00163854 is C26H20BrNO2.
What is the molecular weight of BAS 00163854?
The molecular weight of BAS 00163854 is 457.07 g/mol.
Where can I buy BAS 00163854?
You can request a quote for BAS 00163854 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00163854?
Yes, KEHONG BIO provides custom synthesis services for BAS 00163854 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.