BAS 00163914
TL;DR: BAS 00163914 (CAS 304446-73-9) is a chemical compound with molecular formula C26H17BrClNO4 and molecular weight 521.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(E)-3-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enoyl]-6-chloro-4-phenyl-1H-quinolin-2-one
Also Known As: BAS 00163914, BIM-0007208.P001, AB00666672-01, (E)-3-(3-(7-bromo-2,3-dihydrobenzo[b][1,4]dioxin-6-yl)acryloyl)-6-chloro-4-phenylquinolin-2(1H)-one, F0010-0552
| Molecular Formula | C26H17BrClNO4 |
|---|---|
| Molecular Weight | 521.00 g/mol |
| LogP | 6.2783 |
| Topological Polar Surface Area | 68.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 521.0029 |
| Heavy Atoms | 33 |
| Complexity | 1477.6451 |
Chemical Identifiers
| CAS Number | 304446-73-9 |
|---|---|
| SMILES | C1COC2=C(O1)C=C(C(=C2)Br)/C=C/C(=O)C3=C(C4=C(C=CC(=C4)Cl)NC3=O)C5=CC=CC=C5 |
Product Overview
BAS 00163914 (CAS 304446-73-9), with molecular formula C26H17BrClNO4 and molecular weight 521.00 g/mol. IUPAC: 3-[(E)-3-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enoyl]-6-chloro-4-phenyl-1H-quinolin-2-one.
Chemical Property Profile of BAS 00163914
Property Insights of BAS 00163914
The XLogP value of 6.2783 indicates that BAS 00163914 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.39 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00163914. Following Lipinski's Rule of Five, BAS 00163914 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00163914?
The CAS number of BAS 00163914 is 304446-73-9.
What is the molecular formula of BAS 00163914?
The molecular formula of BAS 00163914 is C26H17BrClNO4.
What is the molecular weight of BAS 00163914?
The molecular weight of BAS 00163914 is 521.00 g/mol.
Where can I buy BAS 00163914?
You can request a quote for BAS 00163914 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00163914?
Yes, KEHONG BIO provides custom synthesis services for BAS 00163914 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.