BAS 13119466
TL;DR: BAS 13119466 (CAS 6172-72-1) is a chemical compound with molecular formula C17H11BrClNO2S2 and molecular weight 438.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[[5-bromo-2-[(2-chlorophenyl)methoxy]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: BAS 13119466, BIM-0010279.P001, 5-{5-bromo-2-[(2-chlorobenzyl)oxy]benzylidene}-2-thioxo-1,3-thiazolidin-4-one, (5E)-5-({5-BROMO-2-[(2-CHLOROPHENYL)METHOXY]PHENYL}METHYLIDENE)-2-SULFANYLIDENE-1,3-THIAZOLIDIN-4-ONE, (5E)-5-[[5-bromo-2-[(2-chlorophenyl)methoxy]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C17H11BrClNO2S2 |
|---|---|
| Molecular Weight | 438.91 g/mol |
| LogP | 5.1703 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 438.9103 |
| Heavy Atoms | 24 |
| Complexity | 854.23425 |
Chemical Identifiers
| CAS Number | 6172-72-1 |
|---|---|
| SMILES | C1=CC=C(C(=C1)COC2=C(C=C(C=C2)Br)/C=C/3\C(=O)NC(=S)S3)Cl |
Product Overview
BAS 13119466 (CAS 6172-72-1), with molecular formula C17H11BrClNO2S2 and molecular weight 438.91 g/mol. IUPAC: (5E)-5-[[5-bromo-2-[(2-chlorophenyl)methoxy]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of BAS 13119466
Property Insights of BAS 13119466
The XLogP value of 5.1703 indicates that BAS 13119466 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.33 Ų, BAS 13119466 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 13119466 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 13119466?
The CAS number of BAS 13119466 is 6172-72-1.
What is the molecular formula of BAS 13119466?
The molecular formula of BAS 13119466 is C17H11BrClNO2S2.
What is the molecular weight of BAS 13119466?
The molecular weight of BAS 13119466 is 438.91 g/mol.
Where can I buy BAS 13119466?
You can request a quote for BAS 13119466 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 13119466?
Yes, KEHONG BIO provides custom synthesis services for BAS 13119466 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.