BAS 00456944
TL;DR: BAS 00456944 (CAS 23509-47-9) is a chemical compound with molecular formula C13H13NO3S2 and molecular weight 295.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-3-ethyl-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: BAS 00456944, (5Z)-3-ethyl-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one, (Z)-3-ethyl-5-(4-hydroxy-3-methoxybenzylidene)-2-thioxothiazolidin-4-one, F0379-0010, 3-Ethyl-5-(4-hydroxy-3-methoxy-benzylidene)-2-thioxo-thiazolidin-4-one
| Molecular Formula | C13H13NO3S2 |
|---|---|
| Molecular Weight | 295.03 g/mol |
| LogP | 2.6219 |
| Topological Polar Surface Area | 49.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 295.0337 |
| Heavy Atoms | 19 |
| Complexity | 569.0068 |
Chemical Identifiers
| CAS Number | 23509-47-9 |
|---|---|
| SMILES | CCN1C(=O)/C(=C/C2=CC(=C(C=C2)O)OC)/SC1=S |
Product Overview
BAS 00456944 (CAS 23509-47-9), with molecular formula C13H13NO3S2 and molecular weight 295.03 g/mol. IUPAC: (5Z)-3-ethyl-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of BAS 00456944
Property Insights of BAS 00456944
The XLogP value of 2.6219 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00456944. With a topological polar surface area (TPSA) of 49.77 Ų, BAS 00456944 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00456944 has 1 hydrogen bond donor(s) and 5 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 00456944?
The CAS number of BAS 00456944 is 23509-47-9.
What is the molecular formula of BAS 00456944?
The molecular formula of BAS 00456944 is C13H13NO3S2.
What is the molecular weight of BAS 00456944?
The molecular weight of BAS 00456944 is 295.03 g/mol.
Where can I buy BAS 00456944?
You can request a quote for BAS 00456944 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00456944?
Yes, KEHONG BIO provides custom synthesis services for BAS 00456944 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.