BAS 00567454
TL;DR: BAS 00567454 (CAS 305377-69-9) is a chemical compound with molecular formula C17H9BrN2O2S2 and molecular weight 415.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-3-(4-hydroxy-3-phenyl-2-sulfanylidene-1,3-thiazol-5-yl)indol-2-one
Also Known As: BAS 00567454, AB00083219-01, AE-641/10054005, (5Z)-5-(5-bromo-2-oxo-1H-indol-3-ylidene)-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one, (Z)-5-(5-bromo-2-oxoindolin-3-ylidene)-3-phenyl-2-thioxothiazolidin-4-one
| Molecular Formula | C17H9BrN2O2S2 |
|---|---|
| Molecular Weight | 415.93 g/mol |
| LogP | 3.09519 |
| Topological Polar Surface Area | 54.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 415.9289 |
| Heavy Atoms | 24 |
| Complexity | 1163.5366 |
Chemical Identifiers
| CAS Number | 305377-69-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=C(SC2=S)C3=C4C=C(C=CC4=NC3=O)Br)O |
Product Overview
BAS 00567454 (CAS 305377-69-9), with molecular formula C17H9BrN2O2S2 and molecular weight 415.93 g/mol. IUPAC: 5-bromo-3-(4-hydroxy-3-phenyl-2-sulfanylidene-1,3-thiazol-5-yl)indol-2-one.
Chemical Property Profile of BAS 00567454
Property Insights of BAS 00567454
The XLogP value of 3.09519 indicates that BAS 00567454 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.59 Ų, BAS 00567454 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00567454 has 1 hydrogen bond donor(s) and 4 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 00567454?
The CAS number of BAS 00567454 is 305377-69-9.
What is the molecular formula of BAS 00567454?
The molecular formula of BAS 00567454 is C17H9BrN2O2S2.
What is the molecular weight of BAS 00567454?
The molecular weight of BAS 00567454 is 415.93 g/mol.
Where can I buy BAS 00567454?
You can request a quote for BAS 00567454 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00567454?
Yes, KEHONG BIO provides custom synthesis services for BAS 00567454 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.