BAS 02056773
TL;DR: BAS 02056773 (CAS 307539-02-2) is a chemical compound with molecular formula C17H17NO5S2 and molecular weight 379.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid
Also Known As: BAS 02056773, 6-[(5E)-5-(2H-1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid, 6-[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid, 6-[(5E)-5-(1,3-benzodioxol-5-ylmethylene)-4-oxo-2-thioxo-thiazolidin-3-yl]hexanoic acid, 6-[(5E)-5-[(2H-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid
| Molecular Formula | C17H17NO5S2 |
|---|---|
| Molecular Weight | 379.05 g/mol |
| LogP | 3.2615 |
| Topological Polar Surface Area | 76.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 379.0548 |
| Heavy Atoms | 25 |
| Complexity | 746.5538 |
Chemical Identifiers
| CAS Number | 307539-02-2 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)/C=C/3\C(=O)N(C(=S)S3)CCCCCC(=O)O |
Product Overview
BAS 02056773 (CAS 307539-02-2), with molecular formula C17H17NO5S2 and molecular weight 379.05 g/mol. IUPAC: 6-[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid.
Chemical Property Profile of BAS 02056773
Property Insights of BAS 02056773
The XLogP value of 3.2615 indicates that BAS 02056773 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.07 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02056773. Following Lipinski's Rule of Five, BAS 02056773 has 1 hydrogen bond donor(s) and 6 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 02056773?
The CAS number of BAS 02056773 is 307539-02-2.
What is the molecular formula of BAS 02056773?
The molecular formula of BAS 02056773 is C17H17NO5S2.
What is the molecular weight of BAS 02056773?
The molecular weight of BAS 02056773 is 379.05 g/mol.
Where can I buy BAS 02056773?
You can request a quote for BAS 02056773 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02056773?
Yes, KEHONG BIO provides custom synthesis services for BAS 02056773 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.