BAS 00449664
TL;DR: BAS 00449664 (CAS 332406-98-1) is a chemical compound with molecular formula C15H12BrNOS2 and molecular weight 364.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[(Z)-2-bromo-3-phenylprop-2-enylidene]-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: BAS 00449664, (5Z)-5-[(Z)-2-bromo-3-phenylprop-2-enylidene]-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C15H12BrNOS2 |
|---|---|
| Molecular Weight | 364.95 g/mol |
| LogP | 4.3526 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 364.95438 |
| Heavy Atoms | 20 |
| Complexity | 607.5593 |
Chemical Identifiers
| CAS Number | 332406-98-1 |
|---|---|
| SMILES | C=CCN1C(=O)/C(=C/C(=C/C2=CC=CC=C2)/Br)/SC1=S |
Product Overview
BAS 00449664 (CAS 332406-98-1), with molecular formula C15H12BrNOS2 and molecular weight 364.95 g/mol. IUPAC: (5Z)-5-[(Z)-2-bromo-3-phenylprop-2-enylidene]-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of BAS 00449664
Property Insights of BAS 00449664
The XLogP value of 4.3526 indicates that BAS 00449664 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, BAS 00449664 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00449664 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 BAS 00449664?
The CAS number of BAS 00449664 is 332406-98-1.
What is the molecular formula of BAS 00449664?
The molecular formula of BAS 00449664 is C15H12BrNOS2.
What is the molecular weight of BAS 00449664?
The molecular weight of BAS 00449664 is 364.95 g/mol.
Where can I buy BAS 00449664?
You can request a quote for BAS 00449664 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00449664?
Yes, KEHONG BIO provides custom synthesis services for BAS 00449664 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.